3-Amino-2-chloro-6-picoline

C₆H₇ClN₂CAS 39745-40-9142.59 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₆H₇ClN₂
Molar mass: 142.59 g/mol
Exact mass: 142.0298 Da
logP: 1.63Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled100% 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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

39745-40-9

SMILES

CC1=NC(=C(C=C1)N)Cl

InChIKey

SUMSBUDMYMYTLL-UHFFFAOYSA-N

InChI

InChI=1S/C6H7ClN2/c1-4-2-3-5(8)6(7)9-4/h2-3H,8H2,1H3

Weigh it out

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

Work with 3-Amino-2-chloro-6-picoline

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

2,6-Dimethyl-3-pyridylamine3430-33-957 % similar 2,6-Dichloro-3-pyridylamine62476-56-657 % similar 2-Bromo-6-methyl-3-pyridinamine126325-53-953 % similar 3-Amino-6-bromo-2-chloropyridine169833-70-953 % similar 3-Bromo-2-chloro-6-picoline185017-72-553 % similar 2-Chloro-3-fluoro-6-methylpyridine374633-32-653 % similar 3-Amino-2-fluoro-6-methylpyridine374633-34-853 % similar 3-Amino-2-methoxy-6-picoline186413-79-652 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(4-Chlorophenyl)hydrazine1073-69-4 2-Chloro-5-ethylpyrimidine111196-81-7 3-Amino-2-chloro-4-methylpyridine133627-45-9 (2-Chloropyridin-4-yl)methanamine144900-57-2 3-Amino-6-chloro-2-picoline164666-68-6 (4-Chloropyridin-2-yl)methanamine180748-30-5 (2-Chloropyridin-3-yl)methanamine205744-14-5 2-Amino-5-chloro-3-methylpyridine20712-16-7

Elsewhere

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