2-Chloro-5-methoxypyrimidine

C5H5ClN2OCAS 22536-65-8144.56 g/mol

Open in Covalent MOL file
ONClN
Aryl halideEther

Properties

Molecular formula
C5H5ClN2O
Molar mass
144.56 g/mol
Exact mass
144.0090 Da
Melting point
51.5 °C
logP
1.14Crippen estimate
Polar surface area
35.0 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 43 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
22536-65-8
SMILES
COc1cnc(Cl)nc1
InChIKey
RSUBGBZOMBTDTI-UHFFFAOYSA-N
InChI
InChI=1S/C5H5ClN2O/c1-9-4-2-7-5(6)8-3-4/h2-3H,1H3

Weigh it out

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

Names and synonyms

2 names
  • Pyrimidine, 2-chloro-5-methoxy-
  • 2-Chloro-5-(methyloxy)pyrimidine

Work with 2-Chloro-5-methoxypyrimidine

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-Bromo-5-methoxypyrimidine1209459-99-356 % similar 2-Amino-5-methoxypyrimidine13418-77-456 % similar 2-Chloro-5-methoxypyridine139585-48-156 % similar 2,4-Dichloro-5-methoxypyrimidine19646-07-248 % similar 2,5-Dimethoxy pyridine867267-24-148 % similar 2-Chloro-5-methylpyrimidine22536-61-446 % similar 5-Bromo-2-chloro-4-methoxypyrimidine57054-92-945 % similar 2-Amino-5-methoxypyridine10167-97-245 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Chloro-5-methoxypyridazine123696-02-6 3-Chloro-6-methoxypyridazine1722-10-7 4-Chloro-1-methyl-1H-pyrazole-3-carbaldehyde175204-81-6 6-Chloro-4-methyl-2H-pyridazin-3-one1834-27-1 2-Chloro-4-methoxypyrimidine22536-63-6 4-Chloro-6-methoxypyrimidine26452-81-3 2-Chloro-6-methoxypyrazine33332-30-8 2-Amino-3-hydroxy-5-chloropyridine40966-87-8

Elsewhere

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