4-(2,2,2-Trifluoroethoxy)benzeneboronic acid
Properties
- Molecular formula
- C8H8BF3O3
- Molar mass
- 219.95 g/mol
- Exact mass
- 220.0519 Da
- logP
- 0.31Crippen estimate
- Polar surface area
- 49.7 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 3
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 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
886536-37-4SMILES
B(C1=CC=C(C=C1)OCC(F)(F)F)(O)OInChIKey
DWRAMTYYMNLVBD-UHFFFAOYSA-NInChI
InChI=1S/C8H8BF3O3/c10-8(11,12)5-15-7-3-1-6(2-4-7)9(13)14/h1-4,13-14H,5H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 4-(2,2,2-Trifluoroethoxy)phenylboronic acid
Work with 4-(2,2,2-Trifluoroethoxy)benzeneboronic acid
Similar compounds
1,4-Bis(2,2,2-trifluoroethoxy)benzene66300-61-667 % similar
4-Trifluoromethoxyphenylboronic acid139301-27-255 % similar
4-Ethoxyphenylboronic acid22237-13-455 % similar
4-Propoxyphenylboronic acid186497-67-651 % similar
4-Benzyloxy-phenylboronic acid146631-00-750 % similar
B-(4-Butoxyphenyl)boronic acid105365-51-349 % similar
(4-Pentyloxyphenyl)boronic acid146449-90-347 % similar
B-[4-(Hexyloxy)phenyl]boronic acid121219-08-746 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.