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CAS No.: | 138-30-7 |
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Name: | 3-HYDRAZINO BENZENESULFONIC ACID |
Molecular Structure: | |
Formula: | C6H8N2O3S |
Molecular Weight: | 188.207 |
Synonyms: | Benzenesulfonicacid, 3-hydrazino- (9CI);Benzenesulfonic acid, m-hydrazino- (7CI,8CI);3-Hydrazinobenzenesulfonic acid;3-Sulfophenylhydrazine;Phenylhydrazine-3-sulfonic acid;m-Hydrazinobenzenesulfonic acid; |
EINECS: | 205-322-7 |
Density: | 1.583 g/cm3 |
PSA: | 100.80000 |
LogP: | 2.07300 |
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The CAS registry number of Benzenesulfonic acid,3-hydrazinyl- is 138-30-7. This chemical is also named as m-Hydrazinobenzenesulphonic acid. Its EINECS registry number is 205-322-7. In addition, its molecular formula is C6H8N2O3S and molecular weight is 188.2. Its systematic name and IUPAC name are the same which is called 3-hydrazinylbenzenesulfonic acid.
Physical properties about Benzenesulfonic acid,3-hydrazinyl- are: (1)ACD/LogP: -0.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.87; (4)ACD/LogD (pH 7.4): -4.23; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.669; (13)Molar Refractivity: 44.37 cm3; (14)Molar Volume: 118.8 cm3; (15)Surface Tension: 80.9 dyne/cm; (16)Density: 1.583 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)c1cccc(NN)c1
(2)InChI: InChI=1/C6H8N2O3S/c7-8-5-2-1-3-6(4-5)12(9,10)11/h1-4,8H,7H2,(H,9,10,11)
(3)InChIKey: ZDGHHRPKFCVOJL-UHFFFAOYAR