3-Fluoro-5-(trifluoromethyl)phenol
Properties
- Molecular formula
- C7H4F4O
- Molar mass
- 180.10 g/mol
- Exact mass
- 180.0198 Da
- logP
- 2.55Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H227 Combustible liquid16.7% of notifiers
- H301 Toxic if swallowed16.7% of notifiers
- H302 Harmful if swallowed83.3% of notifiers
- H311 Toxic in contact with skin16.7% of notifiers
- H312 Harmful in contact with skin16.7% of notifiers
- H314 Causes severe skin burns and eye damage66.7% of notifiers
- H315 Causes skin irritation33.3% of notifiers
- H318 Causes serious eye damage16.7% of notifiers
- H319 Causes serious eye irritation16.7% of notifiers
- H332 Harmful if inhaled83.3% of notifiers
- H335 May cause respiratory irritation33.3% of notifiers
- H411 Toxic to aquatic life with long lasting effects66.7% of notifiers
- H412 Harmful to aquatic life with long lasting effects16.7% of notifiers
Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P363, P370+P378, P391, P403, P403+P233, P405, P501
Identifiers
CAS number
172333-87-8SMILES
C1=C(C=C(C=C1O)F)C(F)(F)FInChIKey
VNTKPYNBATZMSV-UHFFFAOYSA-NInChI
InChI=1S/C7H4F4O/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3,12HWeigh it out
Type any one amount. The others follow from the molar mass.
Work with 3-Fluoro-5-(trifluoromethyl)phenol
Similar compounds
3,5-Bis(trifluoromethyl)phenol349-58-671 % similar
3,5-Difluorophenol2713-34-058 % similar
3-Chloro-5-hydroxybenzotrifluoride570391-18-357 % similar
3-Bromo-5-fluorobenzotrifluoride130723-13-653 % similar
3-Fluoro-5-trifluoromethylaniline454-67-153 % similar
3-Fluoro-5-(trifluoromethyl)benzyl alcohol184970-29-453 % similar
3-(Trifluoromethyl)phenol98-17-950 % similar
3-Fluoro-5-(trifluoromethyl)benzoic acid161622-05-549 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.
Same formula
3-(Trifluoromethoxy)fluorobenzene1077-01-6
4-Fluoro-2-(trifluoromethyl)phenol130047-19-7
2-Fluoro-5-(trifluoromethyl)phenol141483-15-0
2-Fluoro-3-(trifluoromethyl)phenol207291-85-8
1-Fluoro-2-(trifluoromethoxy)benzene2106-18-5
2,3,5,6-Tetrafluoroanisole2324-98-3
5-Fluoro-2-(trifluoromethyl)phenol243459-91-8
1-Fluoro-4-(trifluoromethoxy)benzene352-67-0