2,1,3-Benzoxadiazole-5-carboxylic acid
Properties
- Molecular formula
- C7H4N2O3
- Molar mass
- 164.12 g/mol
- Exact mass
- 164.0222 Da
- logP
- 0.92Crippen estimate
- Polar surface area
- 76.2 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed50% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
19155-88-5SMILES
O=C(O)c1ccc2nonc2c1InChIKey
WZUFYJFTOVGJJT-UHFFFAOYSA-NInChI
InChI=1S/C7H4N2O3/c10-7(11)4-1-2-5-6(3-4)9-12-8-5/h1-3H,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- 5-Benzofurazancarboxylic acid
- Benzo[1,2,5]oxadiazole-5-carboxylic acid
- Benzo[2,1,3]oxadiazole-5-carboxylic acid
- Benzo[c][1,2,5]oxadiazole-5-carboxylic acid
Work with 2,1,3-Benzoxadiazole-5-carboxylic acid
Similar compounds
6-Quinoxalinecarboxylic acid6925-00-461 % similar
2,1,3-Benzoxadiazole-5-carbonyl chloride126147-86-259 % similar
2,1,3-Benzothiadiazole-5-carboxylic acid16405-98-459 % similar
Benzotriazole-5-carboxylic acid23814-12-259 % similar
2,3-Dimethylquinoxaline-6-carboxylic acid17635-26-656 % similar
1H-Benzimidazole-5-carboxylic acid15788-16-654 % similar
5-Carboxybenzofuroxan6086-24-454 % similar
2,6-Naphthalenedicarboxylic acid1141-38-452 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.