4-Chloro-2-methylpyrimidine

C₅H₅ClN₂CAS 4994-86-9128.56 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₅ClN₂
Molar mass: 128.56 g/mol
Exact mass: 128.0141 Da
logP: 1.44Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

4994-86-9

SMILES

CC1=NC=CC(=N1)Cl

InChIKey

WDTVJRYCMIZPMX-UHFFFAOYSA-N

InChI

InChI=1S/C5H5ClN2/c1-4-7-3-2-5(6)8-4/h2-3H,1H3

Weigh it out

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

Work with 4-Chloro-2-methylpyrimidine

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-Dichloropyrimidine3934-20-156 % similar 4-Chloro-2-(methylthio)pyrimidine49844-90-854 % similar 4,6-Dichloro-2-methylpyrimidine1780-26-352 % similar 2-Amino-4-chloropyrimidine3993-78-050 % similar 4-Chloro-2-(methylsulfonyl)pyrimidine97229-11-345 % similar 4-Chloro-2-phenylpyrimidine14790-42-245 % similar 2-Chloro-4-methylpyridine3678-62-445 % similar 4-Chloro-2,6-dimethylpyrimidine4472-45-145 % similar

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

Same formula

5-(Chloromethyl)pyrimidine101346-02-5 2-Amino-5-chloropyridine1072-98-6 3-Chloro-6-methylpyridazine1121-79-5 2-Chloro-4-methylpyrimidine13036-57-2 4-Amino-2-chloropyridine14432-12-3 4-Amino-3-chloropyridine19798-77-7 4-Chloro-2-pyridinamine19798-80-2 4-Chloro-3-pyridinamine20511-15-3

Elsewhere

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