5-Bromo-6-hydroxynicotinic acid
Properties
- Molecular formula
- C6H4BrNO3
- Molar mass
- 218.01 g/mol
- Exact mass
- 216.9375 Da
- logP
- 0.84Crippen estimate
- Polar surface area
- 70.2 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled25% of notifiers
- H302 Harmful if swallowed25% of notifiers
- H312 Harmful in contact with skin25% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled25% of notifiers
- H335 May cause respiratory irritation75% of notifiers
Aggregated from 4 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
41668-13-7SMILES
C1=C(C(=O)NC=C1C(=O)O)BrInChIKey
PQDLYKZCJBGXPQ-UHFFFAOYSA-NInChI
InChI=1S/C6H4BrNO3/c7-4-1-3(6(10)11)2-8-5(4)9/h1-2H,(H,8,9)(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 5-Bromo-6-oxo-1,6-dihydropyridine-3-carboxylic acid
Work with 5-Bromo-6-hydroxynicotinic acid
Similar compounds
5-Chloro-6-hydroxy-3-pyridinecarboxylic acid54127-63-861 % similar
6-Hydroxy-5-nitropyridine-3-carboxylic acid6635-31-057 % similar
Methyl 5-bromo-6-hydroxynicotinate381247-99-056 % similar
3,5-Dibromo-4-hydroxybenzoic acid3337-62-051 % similar
3,4-Dibromobenzoic acid619-03-451 % similar
4-Amino-3,5-dibromobenzoic acid4123-72-250 % similar
3,5-Dibromo-4-methylbenzoic acid67973-32-450 % similar
Bromoterephthalic acid586-35-649 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.