Basic information
- CAS
4750-28-1- Standard SMILES
O=S(=O)(Nc1ccc(Cl)cc1)c1ccccc1- InChIKey
ANRCRHLXUCJAKV-UHFFFAOYSA-N- Molecular formula
- C12H10ClNO2S
- Average molar mass
- 267.73 g/mol
- Monoisotopic mass
- 267.0120774
Names & identifiers
- Preferred name
- N-(4-Chlorophenyl)benzenesulfonamide
- IUPAC
- N-(4-chlorophenyl)benzenesulfonamide
- English name
- N-(4-Chlorophenyl)benzenesulfonamide
- Molecular formula
- C12H10ClNO2S
- Molecular weight
- 267.73
Names & synonyms
N-(4-CHLOROPHENYL)BENZENESULFONAMIDE4750-28-1Benzenesulfonamide, N-(4-chlorophenyl)-MFCD005418643DG76LGR56NSC-62066NSC62066NSC 62066Benzenesulfonamide,N-(4-chlorophenyl)-N-(P-CHLOROPHENYL)BENZENESULFONAMIDEp-chlorobenzenesulfonanilideBionet2_000894
Show more names
N-(4-Chlorophenyl)benzenesulfonamide,97%
UNII-3DG76LGR56CHEMBL181505SCHEMBL2133710SCHEMBL5342570Benzenesulfonanilide, 4'-chloro-DTXSID60197167ANRCRHLXUCJAKV-UHFFFAOYSA-NHMS1366I14
Database identifiers
- CAS
4750-28-1- PubChem CID
- 20865
- DTXSID
DTXSID60197167- ChEMBL
CHEMBL181505- UNII
- 3DG76LGR56
- Nikkaji
- J1.394.444J
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 325
Experimental & physicochemical properties
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
LogP3.44
Physicochemical properties
- Melting point
- 121 · 121-122 °C
- Boiling point
- 407.7 · 407.7±47.0 °C(Predicted)
- Density
- 1.405 · 1.405±0.06 g/cm3(Predicted)
- pka
- 8.02 · 8.02±0.10(Predicted)
- form
- Solid
- color
- Pale purple
- FDA UNII
- 3 DG76LGR56 · 3DG76LGR56
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- HS Code
- 2935909099 · 2935909099
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2935909099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers13 total
陕西格列弗生物科技研究有限责任公司18409274651; 13892423764 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [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]
武汉沃格达生物科技有限公司15071299552 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
长沙福臻生物科技有限公司15111215862 18229892877 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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