4-Benzyloxy-3-fluorophenylboronic Acid
Properties
- Molecular formula
- C13H12BFO3
- Molar mass
- 246.04 g/mol
- Exact mass
- 246.0864 Da
- logP
- 1.08Crippen estimate
- Polar surface area
- 49.7 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 4
Hazards
Warning
- H302 Harmful if swallowed14.3% of notifiers
- H315 Causes skin irritation85.7% of notifiers
- H319 Causes serious eye irritation85.7% of notifiers
- H335 May cause respiratory irritation85.7% of notifiers
Aggregated from 7 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
133057-83-7SMILES
B(C1=CC(=C(C=C1)OCC2=CC=CC=C2)F)(O)OInChIKey
DQPDLDQJMUGVGI-UHFFFAOYSA-NInChI
InChI=1S/C13H12BFO3/c15-12-8-11(14(16)17)6-7-13(12)18-9-10-4-2-1-3-5-10/h1-8,16-17H,9H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 4-(Benzyloxy)-3-fluorophenylboronic acid
Work with 4-Benzyloxy-3-fluorophenylboronic Acid
Similar compounds
4-Benzyloxy-3-methylphenylboronic Acid (contains varying amounts of Anhydride)338454-30-166 % similar
4-Benzyloxy-3-chlorophenylboronic acid845551-44-266 % similar
4-Ethoxy-3-fluorophenylboronic acid279263-10-463 % similar
3-Fluoro-4-propoxyphenylboronic acid192376-68-460 % similar
4-Benzyloxy-phenylboronic acid146631-00-756 % similar
3-Benzyloxy-phenylboronic acid156682-54-156 % similar
3-Fluoro-4-methoxybenzeneboronic acid149507-26-655 % similar
2-Benzyloxyphenylboronic acid190661-29-153 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.