2-Hydrazinobenzoic acid

HCID 79223

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Basic information

CAS: 5326-27-2
Standard SMILES: NNc1ccccc1C(=O)O
InChIKey: KFGVDCBVGNMCJC-UHFFFAOYSA-N
Molecular formula: C7H8N2O2
Average molar mass: 152.15 g/mol
Monoisotopic mass: 152.0585775

Names & identifiers

Preferred name: 2-Hydrazinobenzoic acid
IUPAC: 2-hydrazinylbenzoic acid
English name: 2-hydrazinobenzoic acid
Molecular formula: C7H8N2O2
Molecular weight: 152.15

Names & synonyms

2-Hydrazinobenzoic acid2-hydrazinylbenzoic acid5326-27-2Benzoic acid, 2-hydrazino-WDR9R94GA3NSC-282EINECS 226-202-0DTXSID40201377NSC 282BENZOIC ACID, O-HYDRAZINO-BENZOIC ACID, 2-HYDRAZINYL-RefChem:87327

Show more names

N-Aminoanthranilic acido-Carboxyphenylhydrazine2-Hydrazine benzoic acid(2-Carboxyphenyl)hydrazine2-Carboxyphenylhydrazine, N-Aminoanthranilic acid

DTXCID40123868226-202-0KFGVDCBVGNMCJC-UHFFFAOYSA-NBenzoic acid, hydrazino-o-Hydrazinobenzoic acidMFCD001297682-Hydrazino-benzoic acidhydrazinobenzoic acid

Database identifiers

CAS: 5326-27-2
PubChem CID: 79223
DTXSID: DTXSID40201377
UNII: WDR9R94GA3
EC Number: 226-202-0
Nikkaji: J26.921B

Properties

Computed structural properties

XLogP: -1
Topological polar surface area: 75.4 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 4
Rotatable bonds: 2
Heavy atoms: 11
Formal charge: 0
Complexity: 149

Physicochemical properties

Melting point: 247 °C · 247 °C
Boiling point: 352.3 · 352.3±25.0 °C(Predicted)
Density: 1.401 · 1.401±0.06 g/cm3(Predicted)
solubility: Methanol (Slightly)
form: powder
pka: 3.3 · 3.30±0.36(Predicted)
color: Light brown
FDA UNII: 9 R94GA3 · WDR9R94GA3
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302+H312+H332-H315-H319-H335
Precautionary statements: 301 · P301+P312-P280-P260
HS Code: 2916399090 · 2916399090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.