Cas no 83763-37-5 (Benzoic acid,2-amino-4-sulfo-, sodium salt (1:1))
83763-37-5 structure
Product Name:Benzoic acid,2-amino-4-sulfo-, sodium salt (1:1)
CAS No:83763-37-5
MF:C7H6NNaO5S
MW:239.181011676788
CID:728172
PubChem ID:44147967
Update Time:2025-04-19
Benzoic acid,2-amino-4-sulfo-, sodium salt (1:1) Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid,2-amino-4-sulfo-, sodium salt (1:1)
- sodium hydrogen 4-sulphonatoanthranilate
- sodium,3-amino-4-carboxybenzenesulfonate
- 83763-37-5
- EINECS 280-722-2
-
- Inchi： 1S/C7H7NO5S.Na/c8-6-3-4(14(11,12)13)1-2-5(6)7(9)10;/h1-3H,8H2,(H,9,10)(H,11,12,13);/q;+1/p-1
- InChI Key： CFFDZTADOHGTBA-UHFFFAOYSA-M
- SMILES： S(C1C=CC(C(=O)O)=C(C=1)N)(=O)(=O)[O-].[Na+]
Computed Properties
- Exact Mass: 238.98643775g/mol
- Monoisotopic Mass: 238.98643775g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 325
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 129?2
Benzoic acid,2-amino-4-sulfo-, sodium salt (1:1) Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Ke Chen,Shuai Liu,Liang Mei,Feng Jin,Bo Zhang,Fengxiang Ma,Yewei Chen,Hong Deng,Min Guo,Qingxu Yu Analyst, 2020,145, 1524-1530
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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