Cas no 61810-01-3 (Benzoic acid, 2-hydrazino-5-sulfo-, hydrochloride)
61810-01-3 structure
Product Name:Benzoic acid, 2-hydrazino-5-sulfo-, hydrochloride
CAS No:61810-01-3
MF:C7H9ClN2O5S
MW:268.674759626389
CID:465478
PubChem ID:71391939
Update Time:2025-04-19
Benzoic acid, 2-hydrazino-5-sulfo-, hydrochloride Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-hydrazino-5-sulfo-, hydrochloride
- 2-hydrazinyl-5-sulfobenzoic acid,hydrochloride
- DTXSID90813762
- 61810-01-3
- 2-Hydrazinyl-5-sulfobenzoic acid--hydrogen chloride (1/1)
-
- Inchi： 1S/C7H8N2O5S.ClH/c8-9-6-2-1-4(15(12,13)14)3-5(6)7(10)11;/h1-3,9H,8H2,(H,10,11)(H,12,13,14);1H
- InChI Key： KOJZPZUFBUGSDD-UHFFFAOYSA-N
- SMILES： Cl.S(C1C=CC(=C(C(=O)O)C=1)NN)(=O)(=O)O
Computed Properties
- Exact Mass: 267.99217
- Monoisotopic Mass: 267.9920703g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 336
- 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: 138?2
Experimental Properties
- PSA: 129.72
Benzoic acid, 2-hydrazino-5-sulfo-, hydrochloride Related Literature
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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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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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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