Cas no 95454-01-6 (Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-methylphenyl)amino]-)
![Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-methylphenyl)amino]- structure](https://ossimg.kuujia.com/scimg/95500/95454-01-6x500.png)
95454-01-6 structure
Product Name:Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-methylphenyl)amino]-
CAS No:95454-01-6
MF:C14H13ClN2O4S
MW:340.782021284103
CID:751824
PubChem ID:13348411
Update Time:2025-04-19
Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-methylphenyl)amino]- Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-methylphenyl)amino]-
- 4-chloro-2-(2-methylanilino)-5-sulfamoylbenzoic acid
- DTXSID10537796
- 95454-01-6
-
- Inchi： 1S/C14H13ClN2O4S/c1-8-4-2-3-5-11(8)17-12-7-10(15)13(22(16,20)21)6-9(12)14(18)19/h2-7,17H,1H3,(H,18,19)(H2,16,20,21)
- InChI Key： HSKWHEMHKZEBPL-UHFFFAOYSA-N
- SMILES： ClC1=CC(=C(C(=O)O)C=C1S(N)(=O)=O)NC1C=CC=CC=1C
Computed Properties
- Exact Mass: 340.0284558g/mol
- Monoisotopic Mass: 340.0284558g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 508
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.1
- Topological Polar Surface Area: 118?2
Benzoic acid, 5-(aminosulfonyl)-4-chloro-2-[(2-methylphenyl)amino]- Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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