2-Hydroxy-4,6-dimethylpyrimidine hydrochloride

C6H9ClN2OCAS 34289-60-6160.60 g/mol

Open in Covalent MOL file
NHONHCl
Phenol

Properties

Molecular formula
C6H9ClN2O
Molar mass
160.60 g/mol
Exact mass
160.0403 Da
logP
1.22Crippen estimate
Polar surface area
46.0 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
34289-60-6
SMILES
Cc1cc(C)nc(O)n1.Cl
InChIKey
IFXXETYYSLJRNF-UHFFFAOYSA-N
InChI
InChI=1S/C6H8N2O.ClH/c1-4-3-5(2)8-6(9)7-4;/h3H,1-2H3,(H,7,8,9);1H

Weigh it out

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

Names and synonyms

5 names
  • 2(1H)-Pyrimidinone, 4,6-dimethyl-, hydrochloride (1:1)
  • 2(1H)-Pyrimidinone, 4,6-dimethyl-, monohydrochloride
  • 2-Pyrimidinol, 4,6-dimethyl-, hydrochloride
  • 4,6-Dimethyl-2(1H)-pyrimidinone hydrochloride
  • 4,6-Dimethylpyrimidin-2-ol hydrochloride

Work with 2-Hydroxy-4,6-dimethylpyrimidine hydrochloride

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2-Hydroxy-4,6-dimethylpyrimidine108-79-2Free base Nicarbazin330-95-0Salt

Similar compounds

6-Methyluracil626-48-271 % similar 4-Methyl-2-pyrimidinol monohydrochloride5348-51-657 % similar 4-Hydroxy-6-methyl-2(1H)-pyridinone3749-51-746 % similar 2,6-Dimethyl-4(3H)-pyrimidinone6622-92-046 % similar 2-Chloro-4,6-dimethylpyrimidine4472-44-044 % similar Methylthiouracil56-04-243 % similar 4,6-Dimethyl-2-mercaptopyrimidine22325-27-542 % similar 2-Isopropyl-6-methyl-4-pyrimidinol2814-20-241 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook