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Sodium 3-nitrobenzenesulfonate - 99%, high purity , CAS No.127-68-4

2 Citations

≥99%

CAS#: 127-68-4
Formula: C₆H₄NNaO₅S
Molecular Weight: 225.16
Beilstein Registry Number: 3639982
EC Number: 204-857-3
MDL number: MFCD00007490
PubChem CID: 31389

Item Number

S112893

Grouped product items
SKU	Size	Availability	Price
S112893-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$9.90
S112893-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$26.90
S112893-500g	500g	In stock	$53.90

Basic Description

Synonyms	127-68-4 \| SODIUM 3-NITROBENZENESULFONATE \| 3-Nitrobenzenesulfonic acid sodium salt \| Sodium 3-nitrobenzenesulphonate \| Sodium m-nitrobenzenesulfonate \| Nitrol S \| Benzenesulfonic acid, 3-nitro-, sodium salt \| Tiskan \| 3-Nitrobenzenesulfonic acid, sodium salt \| m-Nitrobenz
Specifications & Purity	≥99%
Storage Temp	Argon charged
Shipped In	Normal
Product Description	Sodium 3-nitrobenzenesulfonate (3-Nitrobenzenesulfonic acid sodium salt) was used in the synthesis of quinoline.

Names and Identifiers

IUPAC Name	sodium;3-nitrobenzenesulfonate
INCHI	InChI=1S/C6H5NO5S.Na/c8-7(9)5-2-1-3-6(4-5)13(10,11)12;/h1-4H,(H,10,11,12);/q;+1/p-1
InChi Key	LJRGBERXYNQPJI-UHFFFAOYSA-M
Canonical SMILES	C1=CC(=CC(=C1)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]
Isomeric SMILES	C1=CC(=CC(=C1)S(=O)(=O)[O-])[N+](=O)[O-].[Na+]
RTECS	DB7195000
PubChem CID	31389
Molecular Weight	225.16
Beilstein	3639982
Reaxy-Rn	749773

Certificates

Certificate of Analysis(COA)

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9 results found

Lot Number	Certificate Type	Date	Item
J1916104	Certificate of Analysis	Jul 31, 2023	S112893
G2326411	Certificate of Analysis	May 19, 2023	S112893
L2206868	Certificate of Analysis	Oct 25, 2022	S112893
L2206869	Certificate of Analysis	Oct 25, 2022	S112893
L2206870	Certificate of Analysis	Oct 25, 2022	S112893
G2214583	Certificate of Analysis	Jun 18, 2022	S112893
G2214594	Certificate of Analysis	Jun 18, 2022	S112893
G2214656	Certificate of Analysis	Jun 18, 2022	S112893
G2214662	Certificate of Analysis	Jun 18, 2022	S112893

Solubility

water: 50 mg/mL, clear to slightly hazy, faintly yellow to yellow

Sensitivity

Moisture sensitive.

Flash Point(°F)

212 °F

Flash Point(°C)

100 °C - closed cup

Melt Point(°C)

70°C

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H319:Causes serious eye irritation H317:May cause an allergic skin reaction
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 ... P272:Contaminated work clothing should not be allowed out of the workplace. P333+P313:IF SKIN irritation or rash occurs: Get medical advice/attention. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help.
RTECS	DB7195000
Reaxy-Rn	749773

Citations of This Product

1. Hongzhi Zhao, Kun Zhang, Kuanjun Fang, Furui Shi, Ying Pan, Fuyun Sun, Dezhen Wang, Ruyi Xie, Weichao Chen. (2022) Insights into coloration enhancement of mercerized cotton fabric on reactive dye digital inkjet printing. RSC Advances, 12 (17): (10386-10394). [PMID:35424988]
2. Rui Zhang, Feng Bao, Zhi-Huan Weng, Li-Shuai Zong, Jin-Yan Wang, Xi-Gao Jian. (2022) A bio-based N-heterocyclic poly(aryl ether ketone) with a high biomass content and superior properties prepared from two derivatives of guaiacol and 2,5-furandicarboxylic acid. POLYMER DEGRADATION AND STABILITY, 195 (109792). [PMID:]

References

1. V Calderara,M Jekel,C Zaror. (2001-11-07) Kinetics of ozone reactions with 1-naphthalene, 1,5-naphthalene and 3-nitrobenzene sulphonic acids in aqueous solutions.. Water science and technology : a journal of the International Association on Water Pollution Research, 44 ((5)): (7-13). [PMID:11695486]
2. Nichina Gomi,Shuji Yoshida,Kazutsugu Matsumoto,Masayuki Okudomi,Hiroki Konno,Toru Hisabori,Yasushi Sugano. (2011-04-29) Degradation of the synthetic dye amaranth by the fungus Bjerkandera adusta Dec 1: inference of the degradation pathway from an analysis of decolorized products.. Biodegradation, 22 ((6)): (1239-1245). [PMID:21526388]
3. Wenyi Zheng,Yongquan Li,Jinping Du,Zongning Yin. (2014-03-08) Fabrication of biocompatible and tumor-targeting hyaluronan nanospheres by a modified desolvation method.. Journal of pharmaceutical sciences, 103 ((5)): (1529-1537). [PMID:24604299]
4. Dwight Macdonald,Anthony Mastracchio,Hélène Perrier,Daniel Dubé,Michel Gallant,Patrick Lacombe,Denis Deschênes,Bruno Roy,John Scheigetz,Kevin Bateman,Chun Li,Laird A Trimble,Stephen Day,Nathalie Chauret,Deborah A Nicoll-Griffith,Jose M Silva,Zheng Huang,France Laliberté,Susana Liu,Diane Ethier,Doug Pon,Eric Muise,Louise Boulet,Chi Chung Chan,Angela Styhler,Stella Charleson,Joseph Mancini,Paul Masson,David Claveau,Donald Nicholson,Mervyn Turner,Robert N Young,Yves Girard. (2005-09-20) Discovery of a substituted 8-arylquinoline series of PDE4 inhibitors: structure-activity relationship, optimization, and identification of a highly potent, well tolerated, PDE4 inhibitor.. Bioorganic & medicinal chemistry letters, 15 ((23)): (5241-5246). [PMID:16168647]
5. Hao Xu,Stephan J Zuend,Matthew G Woll,Ye Tao,Eric N Jacobsen. (2010-02-20) Asymmetric cooperative catalysis of strong Brønsted acid-promoted reactions using chiral ureas.. Science (New York, N.Y.), 327 ((5968)): (986-990). [PMID:20167783]
6. Jay P Kitt,David A Bryce,Shelley D Minteer,Joel M Harris. (2017-02-22) Raman Spectroscopy Reveals Selective Interactions of Cytochrome c with Cardiolipin That Correlate with Membrane Permeability.. Journal of the American Chemical Society, 139 ((10)): (3851-3860). [PMID:28221789]
7. Hongzhi Zhao, Kun Zhang, Kuanjun Fang, Furui Shi, Ying Pan, Fuyun Sun, Dezhen Wang, Ruyi Xie, Weichao Chen. (2022) Insights into coloration enhancement of mercerized cotton fabric on reactive dye digital inkjet printing. RSC Advances, 12 (17): (10386-10394). [PMID:35424988]
8. Rui Zhang, Feng Bao, Zhi-Huan Weng, Li-Shuai Zong, Jin-Yan Wang, Xi-Gao Jian. (2022) A bio-based N-heterocyclic poly(aryl ether ketone) with a high biomass content and superior properties prepared from two derivatives of guaiacol and 2,5-furandicarboxylic acid. POLYMER DEGRADATION AND STABILITY, 195 (109792). [PMID:]

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