(5-Fluoropyridin-3-yl)methanamine

C₆H₇FN₂CAS 23586-96-1126.13 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₇FN₂
Molar mass: 126.13 g/mol
Exact mass: 126.0593 Da
logP: 0.68Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed96.8% of notifiers
H314 Causes severe skin burns and eye damage93.5% of notifiers
H318 Causes serious eye damage90.3% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 31 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P363, P403+P233, P405, P501

Identifiers

CAS number

23586-96-1

SMILES

C1=C(C=NC=C1F)CN

InChIKey

RYICOVXDBBDCNT-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Names and synonyms

1 names

3-Pyridinemethanamine,5-fluoro-(9ci)

Work with (5-Fluoropyridin-3-yl)methanamine

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

5-Fluoro-3-pyridinemethanol22620-32-259 % similar 3,5-Difluorobenzylamine90390-27-558 % similar 3,5-Difluoropyridine71902-33-554 % similar 3-Fluorobenzylamine100-82-352 % similar 5-Fluoro-3-pyridinamine210169-05-448 % similar 5-Pyrimidinemethanamine25198-95-248 % similar 3-Chloro-5-fluorobenzylamine90390-33-347 % similar 4-Fluorobenzylamine140-75-046 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Pyridinamine,5-fluoro-6-methyl-(9ci)110919-71-6 4-Ethyl-5-fluoropyrimidine137234-88-9 2-Fluoro-4-methylpyridin-3-amine173435-32-0 2-Fluoro-3-methyl-5-aminopyridine186593-48-6 (2-Fluorophenyl)hydrazine2368-80-1 3-Amino-6-fluoro-2-methylpyridine28489-47-6 2-Amino-5-fluoro-4-methylpyridine301222-66-2 4-Fluoro-1,2-phenylenediamine367-31-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook