2-Borono-5-fluorobenzoic acid
Properties
- Molecular formula
- C7H6BFO4
- Molar mass
- 183.93 g/mol
- Exact mass
- 184.0343 Da
- logP
- -0.80Crippen estimate
- Polar surface area
- 77.8 Ų
- H-bond donors / acceptors
- 3 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
874290-63-8SMILES
B(C1=C(C=C(C=C1)F)C(=O)O)(O)OInChIKey
FMVANIKYUYQABO-UHFFFAOYSA-NInChI
InChI=1S/C7H6BFO4/c9-4-1-2-6(8(12)13)5(3-4)7(10)11/h1-3,12-13H,(H,10,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 2-Borono-5-fluorobenzoic acid
Similar compounds
4-Fluorophthalic acid320-97-864 % similar
2-Bromo-5-fluorobenzoic acid394-28-561 % similar
2,5-Difluorobenzoic acid2991-28-860 % similar
5-Fluorosalicylic acid345-16-458 % similar
2-Carboxyphenylboronic acid149105-19-157 % similar
2-Chloro-5-fluorobenzoic acid2252-50-857 % similar
5-Fluoro-2-methylbenzoic acid33184-16-657 % similar
2-Amino-5-fluorobenzoic acid446-08-257 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.