2,4,5-Trichloropyridine

C₅H₂Cl₃NCAS 55934-01-5182.43 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₅H₂Cl₃N
Molar mass: 182.43 g/mol
Exact mass: 180.9253 Da
Melting point: 8–9 °C
logP: 3.04Crippen estimate
Polar surface area: 12.9 Å²
H-bond donors / acceptors: 0 / 1
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

55934-01-5

SMILES

Clc1cc(Cl)c(Cl)cn1

InChIKey

ZJKMPIAMSJCNFI-UHFFFAOYSA-N

InChI

InChI=1S/C5H2Cl3N/c6-3-1-5(8)9-2-4(3)7/h1-2H

Weigh it out

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

Names and synonyms

1 names

Pyridine, 2,4,5-trichloro-

Work with 2,4,5-Trichloropyridine

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

2,4-Dichloro-5-methylpyridine56961-78-560 % similar 4,6-Dichloropyridin-3-amine7321-93-960 % similar 5-Bromo-2,4-dichloro-pyridine849937-96-860 % similar 4,6-Dichloropyridine-3-carbaldehyde1060811-62-254 % similar 4,6-Dichloronicotinonitrile166526-03-054 % similar 2,5-Dichloropyridine-4-boronic acid847664-64-654 % similar 2-Amino-4,5-dichloropyridine188577-68-652 % similar 2,5-Dichloropyrazine19745-07-450 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,4,6-Trichloropyridine16063-69-7 2,3,5-Trichloropyridine16063-70-0 3,4,5-Trichloropyridine33216-52-3 2,3,6-Trichloropyridine6515-09-9

Elsewhere

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