Cas no 530-73-4 ( )
structure
Product Name:
CAS No:530-73-4
MF:C13H12N2O4S
MW:292.310381889343
CID:937912
PubChem ID:235965
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 2-[(4-aminophenyl)sulfonylamino]benzoic acid
- SULFANTHROL
- 2-[(4-azanylphenyl)sulfonylamino]benzoic acid
- N-sulfanilyl-anthranilic acid
- N-Sulfanilyl-anthranilsaeure
- sulfanthrole
- Benzoic acid, 2-(((4-aminophenyl)sulfonyl)amino)-
- BDBM50016585
- SCHEMBL15822907
- 10060-70-5
- 2-[[(4-aminophenyl)sulfonyl]amino]benzoic acid
- FQQBKLWSOPUVAC-UHFFFAOYSA-N
- CHEMBL34665
- 2-{[(4-aminophenyl)sulfonyl]amino}benzoic acid
- Oprea1_661976
- 2-[(4-Aminobenzene-1-sulfonyl)amino]benzoic acid
- NSC 37905
- Oprea1_481831
- 2-(4-Amino-benzenesulfonylamino)-benzoic acid
- Benzoic acid, 2-(((4-aminophenyl)sulfonyl)amino)-, monosodium salt
- Benzoic acid, 2-[[(4-aminophenyl)sulfonyl]amino]-
- UNII-X35NR6NFF6
- DTXSID20905624
- NSC37905
- 2-(((4-aminophenyl)sulfonyl)amino)benzoic acid
- NSC-37905
- 530-73-4
- X35NR6NFF6
-
-
- Inchi： 1S/C13H12N2O4S/c14-9-5-7-10(8-6-9)20(18,19)15-12-4-2-1-3-11(12)13(16)17/h1-8,15H,14H2,(H,16,17)
- InChI Key： FQQBKLWSOPUVAC-UHFFFAOYSA-N
- SMILES： S(C1C=CC(=CC=1)N)(NC1C=CC=CC=1C(=O)O)(=O)=O
Computed Properties
- Exact Mass: 292.05186
- Monoisotopic Mass: 292.052
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 438
- 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: 1.4
- Topological Polar Surface Area: 118?2
Experimental Properties
- Density: 1.511g/cm3
- Boiling Point: 540.4oC at 760mmHg
- Flash Point: 280.6oC
- Refractive Index: 1.689
- PSA: 109.49
- LogP: 3.50280
Related Literature
-
Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
-
Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
-
Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
-
Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
-
Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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