3,5-Bis(trifluoromethyl)benzaldehyde
Properties
- Molecular formula
- C9H4F6O
- Molar mass
- 242.12 g/mol
- Exact mass
- 242.0166 Da
- logP
- 3.54Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation98.5% of notifiers
Aggregated from 65 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
401-95-6SMILES
O=Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1InChIKey
LDWLIXZSDPXYDR-UHFFFAOYSA-NInChI
InChI=1S/C9H4F6O/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15/h1-4HWeigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Benzaldehyde, 3,5-bis(trifluoromethyl)-
- 3,5-Ditrifluoromethylbenzaldehyde
- 3,5-(Trifluoromethyl)benzaldehyde
Work with 3,5-Bis(trifluoromethyl)benzaldehyde
Similar compounds
3-Fluoro-5-(trifluoromethyl)benzaldehyde188815-30-774 % similar
3-Bromo-5-(trifluoromethyl)benzaldehyde477535-41-471 % similar
3-(Trifluoromethyl)benzaldehyde454-89-764 % similar
4-(Trifluoromethyl)benzaldehyde455-19-662 % similar
1,3,5-Tris(trifluoromethyl)benzene729-81-757 % similar
3,5-Bis(tert-butyl)benzaldehyde17610-00-356 % similar
1-Ethenyl-3,5-bis(trifluoromethyl)benzene349-59-756 % similar
4'-(Trifluoromethyl)-4-biphenylcarbaldehyde90035-34-055 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.