4-Bromo-2-(trifluoromethyl)aniline
Properties
- Molecular formula
- C7H5BrF3N
- Molar mass
- 240.02 g/mol
- Exact mass
- 238.9557 Da
- Boiling point
- 60.7–62 °C (at 1 Torr)
- logP
- 3.05Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Hazards
Warning
- H302 Harmful if swallowed97.9% of notifiers
- H312 Harmful in contact with skin89.6% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled97.9% of notifiers
- H335 May cause respiratory irritation87.5% of notifiers
Aggregated from 48 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
445-02-3SMILES
Nc1ccc(Br)cc1C(F)(F)FInChIKey
PHXGKHTWEOPCEW-UHFFFAOYSA-NInChI
InChI=1S/C7H5BrF3N/c8-4-1-2-6(12)5(3-4)7(9,10)11/h1-3H,12H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Benzenamine, 4-bromo-2-(trifluoromethyl)-
- o-Toluidine, 4-bromo-α,α,α-trifluoro-
- 4-Bromo-2-(trifluoromethyl)benzenamine
- 2-Amino-5-bromobenzotrifluoride
- 2-(Trifluoromethyl)-4-bromoaniline
- 4-Bromo-2-trifluoromethylphenylamine
- NSC 88311
Work with 4-Bromo-2-(trifluoromethyl)aniline
Similar compounds
4-Fluoro-2-(trifluoromethyl)aniline393-39-563 % similar
3,3'-Bis(trifluoromethyl)benzidine346-88-362 % similar
2-(Trifluoromethyl)benzene-1,4-diamine364-13-660 % similar
2,4-Bis(trifluoromethyl)aniline367-71-560 % similar
1,4-Dibromo-2-(trifluoromethyl)benzene7657-09-260 % similar
5-Bromo-2-fluorobenzotrifluoride393-37-358 % similar
4-Bromo-2-(trifluoromethyl)phenol50824-04-958 % similar
4-Bromo-1-iodo-2-(trifluoromethyl)benzene364-12-556 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.