2,2-Difluoropropylamine hydrochloride

C₃H₈ClF₂NCAS 868241-48-9131.55 g/mol

Open in Covalent MOL file

Alkyl halide Primary amine

Properties

Molecular formula: C₃H₈ClF₂N
Molar mass: 131.55 g/mol
Exact mass: 131.0313 Da
logP: 1.02Crippen estimate
Polar surface area: 26.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 2 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

868241-48-9

SMILES

CC(CN)(F)F.Cl

InChIKey

IDJKGOWDPKVIBR-UHFFFAOYSA-N

InChI

InChI=1S/C3H7F2N.ClH/c1-3(4,5)2-6;/h2,6H2,1H3;1H

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2,2-Difluoropropylamine hydrochloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,2,2-Trifluoroethylamine hydrochloride373-88-650 % similar 2-Methyl-3-aminopropane-2-thiol hydrochloride32047-53-344 % similar 2,2-Difluoro-1-propanol33420-52-938 % similar 1,1,1,3,3-Pentafluorobutane406-58-638 % similar Neopentylamine5813-64-936 % similar 2,2-Dimethyl-1,3-propanediamine7328-91-836 % similar 2,2,2-Trifluoroethylamine753-90-236 % similar 2,2-Diphenylpropylamine hydrochloride40691-66-535 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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