Cas no 62646-30-4 (Benzoic acid, 2-[[[4-(aminosulfonyl)phenyl]sulfonyl]amino]-)
![Benzoic acid, 2-[[[4-(aminosulfonyl)phenyl]sulfonyl]amino]- structure](https://ossimg.kuujia.com/scimg/63000/62646-30-4x500.png)
62646-30-4 structure
Product Name:Benzoic acid, 2-[[[4-(aminosulfonyl)phenyl]sulfonyl]amino]-
CAS No:62646-30-4
MF:C13H12N2O6S2
MW:356.374180793762
CID:436519
PubChem ID:12328623
Update Time:2025-04-19
Benzoic acid, 2-[[[4-(aminosulfonyl)phenyl]sulfonyl]amino]- Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-[[[4-(aminosulfonyl)phenyl]sulfonyl]amino]-
- 2-[(4-sulfamoylphenyl)sulfonylamino]benzoic acid
- 62646-30-4
- 2-[(4-Sulfamoylbenzene-1-sulfonyl)amino]benzoic acid
- DTXSID50490073
-
- Inchi： 1S/C13H12N2O6S2/c14-22(18,19)9-5-7-10(8-6-9)23(20,21)15-12-4-2-1-3-11(12)13(16)17/h1-8,15H,(H,16,17)(H2,14,18,19)
- InChI Key： ORGFTJBXWAFARB-UHFFFAOYSA-N
- SMILES： S(C1C=CC(=CC=1)S(N)(=O)=O)(NC1C=CC=CC=1C(=O)O)(=O)=O
Computed Properties
- Exact Mass: 356.01376
- Monoisotopic Mass: 356.01367845g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 23
- Rotatable Bond Count: 5
- Complexity: 626
- 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: 0.7
- Topological Polar Surface Area: 160?2
Experimental Properties
- PSA: 143.63
Benzoic acid, 2-[[[4-(aminosulfonyl)phenyl]sulfonyl]amino]- Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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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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