2-Chloro-4,6-dimethoxypyrimidine

C₆H₇ClN₂O₂CAS 13223-25-1174.58 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₆H₇ClN₂O₂
Molar mass: 174.58 g/mol
Exact mass: 174.0196 Da
Melting point: 102 °C
logP: 1.15Crippen estimate
Polar surface area: 44.2 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 2

Identifiers

CAS number

13223-25-1

SMILES

COc1cc(OC)nc(Cl)n1

InChIKey

PBEKEFWBLFBSGQ-UHFFFAOYSA-N

InChI

InChI=1S/C6H7ClN2O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3

Weigh it out

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

Names and synonyms

2 names

Pyrimidine, 2-chloro-4,6-dimethoxy-
4,6-Dimethoxy-2-chloropyrimidine

Work with 2-Chloro-4,6-dimethoxypyrimidine

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

2,4,6-Trimethoxypyrimidine13106-85-961 % similar 2-(Chloromethyl)-4,6-dimethoxypyrimidine114108-86-056 % similar 2-Chloro-4-methoxypyrimidine22536-63-656 % similar 2-Chloro-4,6-dimethoxy-1,3,5-triazine3140-73-654 % similar 2,4-Dichloro-6-methoxy-1,3,5-triazine3638-04-854 % similar 2,6-Dimethoxypyridine6231-18-150 % similar 4-Chloro-6-methoxy-2-pyrimidinamine5734-64-547 % similar 4,6-Dimethoxy-2-(methylsulfonyl)pyrimidine113583-35-047 % similar

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

Same formula

4-Aminopyridine-2-carboxylic acid hydrochloride1291487-29-0 4-Chloro-2,6-dimethoxypyrimidine6320-15-6 6-Chloro-1,3-dimethyl-2,4(1H,3H)-pyrimidinedione6972-27-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook