4,6-Dichloropyrimidine

C₄H₂Cl₂N₂CAS 1193-21-1148.97 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₂Cl₂N₂
Molar mass: 148.97 g/mol
Exact mass: 147.9595 Da
Melting point: 67.5 °C
logP: 1.78Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

1193-21-1

SMILES

Clc1cc(Cl)ncn1

InChIKey

XJPZKYIHCLDXST-UHFFFAOYSA-N

InChI

InChI=1S/C4H2Cl2N2/c5-3-1-4(6)8-2-7-3/h1-2H

Weigh it out

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

Names and synonyms

2 names

Pyrimidine, 4,6-dichloro-
NSC 37530

Work with 4,6-Dichloropyrimidine

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

4-Chloro-6-methylpyrimidine3435-25-462 % similar 4-Chloro-6-methoxypyrimidine26452-81-354 % similar 6-Chloro-4-pyrimidinecarboxylic acid37131-91-248 % similar 2,4,6-Trichloropyrimidine3764-01-047 % similar 2,4,5-Trichloropyridine55934-01-545 % similar 4-Chloro-6-(1H-imidazol-1-yl)pyrimidine114834-02-545 % similar 2,4-Dichloropyridine26452-80-243 % similar Dichloro-S-triazine2831-66-542 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3,6-Dichloropyridazine141-30-0 3,4-Dichloropyridazine1677-80-1 2,5-Dichloropyrimidine22536-67-0 2,4-Dichloropyrimidine3934-20-1 2,6-Dichloropyrazine4774-14-5 2,3-Dichloropyrazine4858-85-9

Elsewhere

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