3-(4-Bromo-2-fluorophenyl)propanoic acid
Properties
- Molecular formula
- C9H8BrFO2
- Molar mass
- 247.06 g/mol
- Exact mass
- 245.9692 Da
- logP
- 2.61Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 3
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the 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
134057-95-7SMILES
C1=CC(=C(C=C1Br)F)CCC(=O)OInChIKey
FLAFQUSRGQNQFJ-UHFFFAOYSA-NInChI
InChI=1S/C9H8BrFO2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 3-(4-Bromo-2-fluoro-phenyl)-propionic acid
Work with 3-(4-Bromo-2-fluorophenyl)propanoic acid
Similar compounds
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3-(2-Bromophenyl)propionic acid15115-58-950 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds