2-Chloro-5-(chloromethyl)pyridine

C₆H₅Cl₂NCAS 70258-18-3162.01 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₆H₅Cl₂N
Molar mass: 162.01 g/mol
Exact mass: 160.9799 Da
Melting point: 96–98 °C
Boiling point: 50 °C (at 0.5 Torr)
logP: 2.47Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed94% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H317 May cause an allergic skin reaction12% of notifiers

Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P270, P272, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P333+P317, P362+P364, P363, P405, P501

Identifiers

CAS number

70258-18-3

SMILES

ClCc1ccc(Cl)nc1

InChIKey

SKCNYHLTRZIINA-UHFFFAOYSA-N

InChI

InChI=1S/C6H5Cl2N/c7-3-5-1-2-6(8)9-4-5/h1-2,4H,3H2

Weigh it out

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

Names and synonyms

7 names

Pyridine, 2-chloro-5-(chloromethyl)-
3-(Chloromethyl)-6-chloropyridine
5-(Chloromethyl)-2-chloropyridine
2-Chloropyridin-5-ylmethyl chloride
6-Chloro-3-(chloromethyl)pyridine
2-Chloro-5-pyridylmethyl chloride
(6-Chloro-3-pyridyl)methyl chloride

Work with 2-Chloro-5-(chloromethyl)pyridine

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

(6-Chloropyridin-3-yl)methanol21543-49-761 % similar 6-Chloro-3-pyridinemethanamine97004-04-161 % similar 2-(6-Chloropyridin-3-yl)acetonitrile39891-09-355 % similar 5-(Chloromethyl)-2-(trifluoromethyl)pyridine386715-33-950 % similar 2-(6-Chloropyridin-3-yl)acetic acid39891-13-950 % similar 2,5-Dichloropyridine16110-09-148 % similar Alpha,alpha'-Dichloro-p-xylene623-25-648 % similar 2-Chloro-5-methylpyridine18368-64-445 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Chloro-2-(chloromethyl)pyridine10177-24-9 2-Chloro-4-(chloromethyl)pyridine101990-73-2 2,4-Dichloro-3-methylpyridine132097-09-7 2,6-Dichloro-4-methylpyridine39621-00-6 2,4-Dichloro-6-methylpyridine42779-56-6 2,4-Dichloroaniline554-00-7 2,4-Dichloro-5-methylpyridine56961-78-5 2,6-Dichloro-3-methylpyridine58584-94-4

Elsewhere

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