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2,5-Dimethylbenzenethiol - 98%, high purity , CAS No.4001-61-0

≥98%

CAS#: 4001-61-0
Formula: (CH₃)₂C₆H₃SH
Molecular Weight: 138.23
Beilstein Registry Number: 6(4)3170
EC Number: 223-649-3
MDL number: MFCD00010020
PubChem CID: 77615

Item Number

D101775

Grouped product items
SKU	Size	Availability	Price
D101775-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$61.90
D101775-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$276.90
D101775-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$995.90

View related series

Non heterocyclic block Sulfur containing compounds

Basic Description

Synonyms	2,5-Dimethylthiophenol \| 2,5-Dimethylbenzenethiol \| 4001-61-0 \| Benzenethiol, 2,5-dimethyl- \| 2,5-Xylenethiol \| 2,5-dimethylbenzene-1-thiol \| 2,5-Dimethyl thiophenol \| MFCD00010020 \| 2,5-dimethyl-benzenethiol \| 2NV04MU9ER \| EINECS 223-649-3 \| p-Xylenethiol \| 2-Mercapto-p-xylene \|
Specifications & Purity	≥98%
Storage Temp	Argon charged
Shipped In	Normal
Product Description	2,5-Dimethylbenzenethiol was used in the synthesis of poly(2-dodecanoylsulfanyl-p-phenylenevinylene). It was also used in the synthesis of 1,1,2-trichloro-4-(2,5-dimethylphenylthio)-1-buten-3-yne; 1,1,2,4-tetrachloro-4-(2,5-dimethylphenylthio)-1,3-butadiene and 1,1,2-trichloro-4,4-bis(2,5-dimethylphenylthio)-1,3-butadiene.

Names and Identifiers

IUPAC Name	2,5-dimethylbenzenethiol
INCHI	InChI=1S/C8H10S/c1-6-3-4-7(2)8(9)5-6/h3-5,9H,1-2H3
InChi Key	NHAUBUMQRJWWAT-UHFFFAOYSA-N
Canonical SMILES	CC1=CC(=C(C=C1)C)S
Isomeric SMILES	CC1=CC(=C(C=C1)C)S
WGK Germany	3
PubChem CID	77615
Molecular Weight	138.23
Beilstein	6(4)3170
Reaxy-Rn	2040348

Certificates

Certificate of Analysis(COA)

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5 results found

Lot Number	Certificate Type	Date	Item
B1828083	Certificate of Analysis	Jun 06, 2023	D101775
I2202397	Certificate of Analysis	Jul 01, 2022	D101775
I2202410	Certificate of Analysis	Jul 01, 2022	D101775
I2202411	Certificate of Analysis	Jul 01, 2022	D101775
F2424511	Certificate of Analysis	May 14, 2021	D101775

Sensitivity

air sensitive

Freezing Point(°C)

15 °C

Refractive Index

1.5698

Flash Point(°F)

181.4 °F

Flash Point(°C)

83 °C

Boil Point(°C)

126.3°C/50mmHg

Melt Point(°C)

15 °C

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation H302:Harmful if swallowed H312:Harmful in contact with skin
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). P405:Store locked up. 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. P403+P233:Store in a well-ventilated place. Keep container tightly closed. 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. P317:Get emergency medical help. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
WGK Germany	3
Reaxy-Rn	2040348

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2,5-Dimethylbenzenethiol - 98%, high purity , CAS No.4001-61-0

Basic Description

Associated Targets(non-human)