2,4-Bis(trifluoromethyl)aniline
Properties
- Molecular formula
- C8H5F6N
- Molar mass
- 229.13 g/mol
- Exact mass
- 229.0326 Da
- logP
- 3.31Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H301 Toxic if swallowed14.3% of notifiers
- H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled14.3% of notifiers
- H302 Harmful if swallowed57.1% of notifiers
- H311 Toxic in contact with skin14.3% of notifiers
- H312 Harmful in contact with skin57.1% of notifiers
- H315 Causes skin irritation85.7% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled57.1% of notifiers
- H335 May cause respiratory irritation14.3% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure71.4% of notifiers
- H412 Harmful to aquatic life with long lasting effects14.3% of notifiers
Aggregated from 7 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
367-71-5SMILES
C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)NInChIKey
UIWVOUBVGBJRNP-UHFFFAOYSA-NInChI
InChI=1S/C8H5F6N/c9-7(10,11)4-1-2-6(15)5(3-4)8(12,13)14/h1-3H,15H2Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 2,4-Bis(trifluoromethyl)aniline
Similar compounds
3,4-Diaminobenzotrifluoride368-71-869 % similar
3,3'-Bis(trifluoromethyl)benzidine346-88-367 % similar
2-(Trifluoromethyl)benzene-1,4-diamine364-13-664 % similar
4-Fluoro-2-(trifluoromethyl)aniline393-39-562 % similar
2-Fluoro-4-(trifluoromethyl)aniline69409-98-962 % similar
2-Iodo-4-(trifluoromethyl)aniline163444-17-560 % similar
2-Chloro-4-trifluoromethylaniline39885-50-260 % similar
4-Bromo-2-(trifluoromethyl)aniline445-02-360 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.