Cas no 104941-53-9 (5-[[(4-Chlorophenyl)amino]sulfonyl]-2-methylBenzoic acid)
![5-[[(4-Chlorophenyl)amino]sulfonyl]-2-methylBenzoic acid structure](https://ossimg.kuujia.com/scimg/105000/104941-53-9x500.png)
104941-53-9 structure
Product Name:5-[[(4-Chlorophenyl)amino]sulfonyl]-2-methylBenzoic acid
CAS No:104941-53-9
MF:C14H12ClNO4S
MW:325.767381668091
CID:2107562
Update Time:2023-08-03
5-[[(4-Chlorophenyl)amino]sulfonyl]-2-methylBenzoic acid Chemical and Physical Properties
Names and Identifiers
-
- 5-[[(4-chlorophenyl)amino]sulfonyl]-2-methylBenzoic acid
- 5-{[(4-chlorophenyl)amino]sulfonyl}-2-methylbenzoic acid
- Cambridge id 6675911
- Oprea1_080332
- 5-[(4-chlorophenyl)sulfamoyl]-2-methylbenzoic acid
- STK675449
- ST4046814
- 5-[(4-chloroanilino)sulfonyl]-2-methylbenzoic acid
- 5-[[(4-Chlorophenyl)amino]sulfonyl]-2-methylBenzoic acid
-
- Inchi： 1S/C14H12ClNO4S/c1-9-2-7-12(8-13(9)14(17)18)21(19,20)16-11-5-3-10(15)4-6-11/h2-8,16H,1H3,(H,17,18)
- InChI Key： ZPYMHPJLWVFYFC-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)NS(C1C=CC(C)=C(C(=O)O)C=1)(=O)=O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 21
- Rotatable Bond Count: 4
- Complexity: 468
- Topological Polar Surface Area: 91.8
5-[[(4-Chlorophenyl)amino]sulfonyl]-2-methylBenzoic acid Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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