Grouped product items

SKU

Size

Availability

Price

Qty

B152759-200mg

200mg

Available within 8-12 weeks(?)

$89.90

B152759-250mg

250mg

In stock

$97.90

B152759-1g

Available within 4-8 weeks(?)

$296.90

B152759-5g

Available within 4-8 weeks(?)

$1,264.90

Basic Description

Synonyms	1,2-Benzenedithiol \| 17534-15-5 \| Benzene-1,2-dithiol \| Benzenedithiol \| 1,2-Dimercaptobenzene \| Dithiocatechol \| o-Benzenedithiol \| MFCD00004835 \| F7M2QCZ9RB \| NSC-623558 \| dimercaptobenzene \| o-dimercaptobenzene \| EINECS 241-530-4 \| NSC623558 \| DITHIOPYROCATECHOL \| UNII-F7M2QCZ9RB \| S
Specifications & Purity	≥95%(GC)
Storage Temp	Store at -20°C,Argon charged
Shipped In	Ice chest + Ice pads
Product Description	The transition metal complexes with 1,2-Benzenedithiol as ligand were studied by UV-vis, resonance Raman (rR) and infrared (IR) spectroscopies

Associated Targets(Human)

ARG1 Tchem Arginase-1 (0 Activities)

Discover Target: ARG1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ACHN (49357 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

CAKI-1 (44928 Activities)

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COLO 205 (50209 Activities)

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DLD-1 (17511 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

DMS-273 (14108 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HL-60 (67320 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HT-29 (80576 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

K562 (73714 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

M14 (47487 Activities)

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OVCAR-3 (48710 Activities)

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OVCAR-4 (44535 Activities)

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OVCAR-8 (47708 Activities)

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RXF 393 (41971 Activities)

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RXF 631 (11415 Activities)

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SF-295 (48000 Activities)

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SK-MEL-28 (48833 Activities)

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SK-OV-3 (52876 Activities)

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SN12C (47755 Activities)

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SNB-19 (46794 Activities)

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SNB-78 (14240 Activities)

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TK-10 (45540 Activities)

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U-251 (51189 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

UACC-62 (47335 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

UO-31 (46270 Activities)

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XF498 (12972 Activities)

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786-0 (47912 Activities)

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A549 (127892 Activities)

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EKVX (44102 Activities)

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NCI-H322M (45589 Activities)

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HCC 2998 (41480 Activities)

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HOP-18 (11577 Activities)

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HOP-92 (41141 Activities)

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NCI-H460 (60772 Activities)

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SF-268 (49410 Activities)

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IGROV-1 (47897 Activities)

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KM-20L2 (14967 Activities)

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LOX IMVI (44321 Activities)

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HOP-62 (47048 Activities)

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LXFL 529 (14112 Activities)

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M19-MEL (15326 Activities)

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Malme-3M (44254 Activities)

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NCI-H23 (49055 Activities)

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SW-620 (52400 Activities)

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HCT-15 (51914 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

DMS-114 (15429 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

ARG1 Arginase-1 (70 Activities)

Discover Target: ARG1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Names and Identifiers

IUPAC Name	benzene-1,2-dithiol
INCHI	InChI=1S/C6H6S2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H
InChi Key	JRNVQLOKVMWBFR-UHFFFAOYSA-N
Canonical SMILES	C1=CC=C(C(=C1)S)S
Isomeric SMILES	C1=CC=C(C(=C1)S)S
WGK Germany	3
PubChem CID	69370
Molecular Weight	142.23
Beilstein	636154
Reaxy-Rn	636154

Certificates

Certificate of Analysis(COA)

Enter Lot Number to search for COA:

To view the certificate results,please click on a Lot number.For Lot numbers from past orders,please use our order status section

7 results found

Lot Number	Certificate Type	Date	Item
J2327042	Certificate of Analysis	Aug 29, 2023	B152759
J2327043	Certificate of Analysis	Aug 29, 2023	B152759
J2228384	Certificate of Analysis	Jul 19, 2022	B152759
J2228385	Certificate of Analysis	Jul 19, 2022	B152759
J2228386	Certificate of Analysis	Jul 19, 2022	B152759
C2218118	Certificate of Analysis	Jan 19, 2022	B152759
C2218119	Certificate of Analysis	Jan 19, 2022	B152759

Chemical and Physical Properties

Solubility	water: slightly soluble; Soluble in benzene, ethanol, diethyl ether, ethyl acetate.
Sensitivity	Air Sensitive
Flash Point(°F)	217 °F
Flash Point(°C)	103°C
Boil Point(°C)	119-120 °C/17 mmHg
Melt Point(°C)	22-24°C

Safety and Hazards(GHS)

Pictogram(s)	GHS05, GHS07
Signal	Danger
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H302:Harmful if swallowed H318:Causes serious eye damage H312:Harmful in contact with skin H332:Harmful if inhaled
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P270:Do not eat, drink or smoke when using this product. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P362+P364:Take off contaminated clothing and wash it before reuse. P330:Rinse mouth. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P301+P317:IF SWALLOWED: Get medical help. P305+P354+P338:IF IN EYES: Immediately rinse with water for several minutes. Remove contact lenses if present and easy to do. Continue rinsing. P317:Get emergency medical help. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help.
WGK Germany	3
Reaxy-Rn	636154

Citations of This Product

1. Wenzhe Xu, Yang Chen, Ruixu Yang, Yiying Fu, Wanxin Zhuang, Yonggang Wang, Yi Liu, Hao Zhang. (2023) “Reaction”-Like Shaping of Self-Delivery Supramolecular Nanodrugs in the Nanoprecipitation Process. ACS Nano, 17 (18): (18227–18239). [PMID:37668306]

References

1. Y Zhang,K L Wade,T Prestera,P Talalay. (1996-08-01) Quantitative determination of isothiocyanates, dithiocarbamates, carbon disulfide, and related thiocarbonyl compounds by cyclocondensation with 1,2-benzenedithiol.. Analytical biochemistry, 239 ((2)): (160-167). [PMID:8811900]
2. Ikram Debbarh,Karine Titier,Evelyne Deridet,Nicholas Moore. (2004-02-28) Identification and quantitation by high-performance liquid chromatography of mancozeb following derivatization by 1,2-benzenedithiol.. Journal of analytical toxicology, 28 ((1)): (41-45). [PMID:14987423]
3. Taras Petrenko,Kallol Ray,Karl E Wieghardt,Frank Neese. (2006-03-30) Vibrational markers for the open-shell character of transition metal bis-dithiolenes: an infrared, resonance raman, and quantum chemical study.. Journal of the American Chemical Society, 128 ((13)): (4422-4436). [PMID:16569020]
4. Kallol Ray,Serena Debeer George,Edward I Solomon,Karl Wieghardt,Frank Neese. (2007-02-10) Description of the ground-state covalencies of the bis(dithiolato) transition-metal complexes from X-ray absorption spectroscopy and time-dependent density-functional calculations.. Chemistry (Weinheim an der Bergstrasse, Germany), 13 ((10)): (2783-2797). [PMID:17290468]
5. Koji Baba,Taka-aki Okamura,Hitoshi Yamamoto,Tetsuo Yamamoto,Norikazu Ueyama. (2008-03-12) Zinc, cadmium, and mercury 1,2-benzenedithiolates with intramolecular NH...S hydrogen bonds.. Inorganic chemistry, 47 ((7)): (2837-2848). [PMID:18330987]
6. Jeremy S Evans,Troy Van Voorhis. (2009-06-09) Dynamic current suppression and gate voltage response in metal-molecule-metal junctions.. Nano letters, 9 ((7)): (2671-2675). [PMID:19499901]
7. N Raman,R Jeyamurugan,R Senthilkumar,B Rajkapoor,Scott G Franzblau. (2010-09-25) In vivo and in vitro evaluation of highly specific thiolate carrier group copper(II) and zinc(II) complexes on Ehrlich ascites carcinoma tumor model.. European journal of medicinal chemistry, 45 ((11)): (5438-5451). [PMID:20864225]
8. Jonathan Onuegbu,Anqie Fu,Orest Glembocki,Shaka Pokes,Dimitri Alexson,Charles M Hosten. (2011-05-03) Investigation of chemically modified barium titanate beads as surface-enhanced Raman scattering (SERS) active substrates for the detection of benzene thiol, 1,2-benzene dithiol, and rhodamine 6G.. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 79 ((3)): (456-461). [PMID:21531612]
9. Yuichi Nakamura,Takeshi Matsumoto,Yasutaka Sakazume,Junnosuke Murata,Ho-Chol Chang. (2018-03-06) Tuning the Mesomorphism and Redox Response of Anionic-Ligand-Based Mixed-Valent Nickel(II) Complexes by Alkyl-Substituted Quaternary Ammonium Cations.. Chemistry (Weinheim an der Bergstrasse, Germany), 24 ((29)): (7398-7409). [PMID:29504636]
10. Yuanfeng Wu,Yuke Shen,Ye Zhu,Jothame Mupunga,Ligen Zou,Chao Liu,Shiwang Liu,Jianwei Mao. (2019-02-19) Broccoli ingestion increases the glucosinolate hydrolysis activity of microbiota in the mouse gut.. International journal of food sciences and nutrition, 70 ((5)): (585-594). [PMID:30773072]
11. Mengwei Sun,Yi Shi,Utkarsh J Dang,Anthony J Di Pasqua. (2019-03-01) Phenethyl Isothiocyanate and Cisplatin Co-Encapsulated in a Liposomal Nanoparticle for Treatment of Non-Small Cell Lung Cancer.. Molecules (Basel, Switzerland), 24 ((4)): [PMID:30813352]
12. Masuma Zawari,Bettina Poller,Greg Walker,Andree Pearson,Mark Hampton,Anitra C Carr. (2019-09-05) Formulation of Broccoli Sprout Powder in Gastro-Resistant Capsules Protects against the Acidic pH of the Stomach In Vitro but Does Not Increase Isothiocyanate Bioavailability In Vivo.. Antioxidants (Basel, Switzerland), 8 ((9)): [PMID:31480621]
13. Valentina Straniero,Lorenzo Suigo,Andrea Casiraghi,Victor Sebastián-Pérez,Martina Hrast,Carlo Zanotto,Irena Zdovc,Carlo De Giuli Morghen,Antonia Radaelli,Ermanno Valoti. (2020-04-09) Benzamide Derivatives Targeting the Cell Division Protein FtsZ: Modifications of the Linker and the Benzodioxane Scaffold and Their Effects on Antimicrobial Activity.. Antibiotics (Basel, Switzerland), 9 ((4)): [PMID:32260339]
14. Ositomiwa O Osipitan,Yi Shi,Anthony J Di Pasqua. (2021-01-21) Phenethyl Isothiocyanate-Containing Carbomer Gel for Use against Squamous Cell Carcinoma.. Pharmaceutics, 13 ((1)): [PMID:33467626]
15. Lingxiang Ye,Albena T Dinkova-Kostova,Kristina L Wade,Yuesheng Zhang,Theresa A Shapiro,Paul Talalay. (2001-12-26) Quantitative determination of dithiocarbamates in human plasma, serum, erythrocytes and urine: pharmacokinetics of broccoli sprout isothiocyanates in humans.. Clinica chimica acta; international journal of clinical chemistry, 316 ((1-2)): (43-53). [PMID:11750273]
16. F Ekkehardt Hahn,Christian Schulze Isfort,Tania Pape. (2004-08-19) A dinuclear, triple-stranded helicate with a diamide-bridged catechol/benzenedithiol ligand.. Angewandte Chemie (International ed. in English), 43 ((36)): (4807-4810). [PMID:15317008]
17. Yuesheng Zhang. (2012-03-29) The 1,2-benzenedithiole-based cyclocondensation assay: a valuable tool for the measurement of chemopreventive isothiocyanates.. Critical reviews in food science and nutrition, 52 ((6)): (525-532). [PMID:22452732]
18. Xiulong Jin,Boris N Khlebtsov,Vitaly A Khanadeev,Nikolai G Khlebtsov,Jian Ye. (2017-08-22) Rational Design of Ultrabright SERS Probes with Embedded Reporters for Bioimaging and Photothermal Therapy.. ACS applied materials & interfaces, 9 ((36)): (30387-30397). [PMID:28825458]
19. Luisa Ugolini,Eleonora Pagnotta,Roberto Matteo,Lorena Malaguti,Alessandra Di Francesco,Luca Lazzeri. (2019-02-26) Brassica meal-derived allyl-isothiocyanate postharvest application: influence on strawberry nutraceutical and biochemical parameters.. Journal of the science of food and agriculture, 99 ((9)): (4235-4241). [PMID:30801703]
20. Toshiyuki Nakamura,Yoshiyuki Murata,Yoshimasa Nakamura. (2019-07-10) Characterization of benzyl isothiocyanate extracted from mashed green papaya by distillation.. Food chemistry, 299 (125118-125118). [PMID:31288160]
21. Wenzhe Xu, Yang Chen, Ruixu Yang, Yiying Fu, Wanxin Zhuang, Yonggang Wang, Yi Liu, Hao Zhang. (2023) “Reaction”-Like Shaping of Self-Delivery Supramolecular Nanodrugs in the Nanoprecipitation Process. ACS Nano, 17 (18): (18227–18239). [PMID:37668306]

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1,2-Benzenedithiol - >95.0%(GC), high purity , CAS No.17534-15-5