(3-Fluoropyridin-2-yl)methanamine dihydrochloride

C₆H₉Cl₂FN₂CAS 312904-49-7199.05 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₉Cl₂FN₂
Molar mass: 199.05 g/mol
Exact mass: 198.0127 Da
logP: 1.52Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from the 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

312904-49-7

SMILES

C1=CC(=C(N=C1)CN)F.Cl.Cl

InChIKey

FUPNXLAWWSHZPJ-UHFFFAOYSA-N

InChI

InChI=1S/C6H7FN2.2ClH/c7-5-2-1-3-9-6(5)4-8;;/h1-3H,4,8H2;2*1H

Weigh it out

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

Names and synonyms

1 names

2-Aminomethyl-3-fluoropyridine dihydrochloride

Work with (3-Fluoropyridin-2-yl)methanamine dihydrochloride

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

3-Fluoro-2-pyridinemethanol31181-79-055 % similar 3-Methyl-2-pyridinemethanamine153936-26-650 % similar 2-Aminomethylpyrimidine hydrochloride372118-67-747 % similar (3-Chloropyrazin-2-yl)methanamine hydrochloride939412-86-946 % similar 2-Amino-3-fluoropyridine21717-95-345 % similar 2,3-Difluoropyridine1513-66-244 % similar 2,6-Difluorobenzylamine69385-30-444 % similar 2-Fluorobenzylamine89-99-642 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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