Basic information
- CAS
6333-79-5- Standard SMILES
CNS(=O)(=O)c1ccc(Cl)cc1- InChIKey
PJHYEBDREIJPKX-UHFFFAOYSA-N- Molecular formula
- C7H8ClNO2S
- Average molar mass
- 205.66 g/mol
- Monoisotopic mass
- 204.99642718
Names & identifiers
- Preferred name
- 4-Chloro-N-methylbenzenesulfonamide
- IUPAC
- 4-chloro-N-methylbenzenesulfonamide
- English name
- 4-Chloro-N-methylbenzenesulphonamide
- Molecular formula
- C7H8ClNO2S
- Molecular weight
- 205.66
Names & synonyms
4-Chloro-N-methylbenzenesulfonamide6333-79-5DTXSID20283358RefChem:1070531DTXCID402345094-Chloro-N-methylbenzenesulphonamide4-chloro-N-methylbenzene-1-sulfonamideMFCD00464330CHEMBL38105[(4-chlorophenyl)sulfonyl]methylaminen-methyl-4-chlorobenzenesulfonamide1-[(N-Methylamino)sulfonyl]-4-chloro-benzene; N-Methyl-4-chlorobenzenesulfonamide; N-Methyl-p-chlorobenzenesulfonamide; NSC 31051; NSC 404320
Show more names
Benzenesulfonamide,4-chloro-N-methyl-
NSC310514-Chloro-N-methyl-benzenesulfonamideSCHEMBL1045254SCHEMBL2442743SCHEMBL2442745SCHEMBL6363790N-methyl-p-chlorobenzenesulfamideHMS1787H12
Database identifiers
- CAS
6333-79-5- PubChem CID
- 232992
- DTXSID
DTXSID20283358- ChEMBL
CHEMBL38105- Nikkaji
- J986.154H
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 226
Experimental & physicochemical properties
LogP1.92
Physicochemical properties
- Melting point
- 52 · 52-54
- Boiling point
- 312.5 · 312.5±44.0 °C(Predicted)
- Density
- 1.353 · 1.353±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Acetonitrile (Slightly), Chloroform (Slightly)
- form
- Solid
- pka
- 11.1 · 11.10±0.30(Predicted)
- color
- Light Beige to Beige
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P271-P280
- Hazard Codes
- Xi
Safety & regulation
Safety data
- hs_code
- 2935909099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P271-P280
Chemistry & industry
Applications
Uses4-Chloro-N-methylbenzenesulphonamide can be used as a iridium catalyst.
Suppliers25 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
郑州康弗辰医药科技有限公司18210788515; 18210788515 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
安阳鸿蒙新材料有限公司
Related reactions
3 records
Compound notes
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