2-(Trifluoromethyl)pyrrolidine
Properties
- Molecular formula
- C5H8F3N
- Molar mass
- 139.12 g/mol
- Exact mass
- 139.0609 Da
- logP
- 1.30Crippen estimate
- Polar surface area
- 12.0 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 0
Hazards
Danger
- H226 Flammable liquid and vapor95.7% of notifiers
- H302 Harmful if swallowed83% of notifiers
- H314 Causes severe skin burns and eye damage10.6% of notifiers
- H315 Causes skin irritation89.4% of notifiers
- H319 Causes serious eye irritation89.4% of notifiers
- H335 May cause respiratory irritation89.4% of notifiers
Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
119618-29-0SMILES
C1CC(NC1)C(F)(F)FInChIKey
VINAMCOZNJHNIH-UHFFFAOYSA-NInChI
InChI=1S/C5H8F3N/c6-5(7,8)4-2-1-3-9-4/h4,9H,1-3H2Weigh it out
Type any one amount. The others follow from the molar mass.
Work with 2-(Trifluoromethyl)pyrrolidine
Similar compounds
3-(Trifluoromethyl)piperidine768-31-048 % similar
4-(Trifluoromethyl)piperidine657-36-338 % similar
α,α-Diphenyl-L-prolinol112068-01-638 % similar
(R)-α,α-Diphenylprolinol22348-32-938 % similar
(2R)-2-Methylpyrrolidine41720-98-335 % similar
(2S)-2-Methylpyrrolidine59335-84-135 % similar
2-Methylpyrrolidine765-38-835 % similar
(4aS,7aS)-Octahydro-1H-pyrrolo[3,4-b]pyridine151213-40-034 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.