4-Methyl-2-pyrimidinol monohydrochloride

C5H7ClN2OCAS 5348-51-6146.57 g/mol

Open in Covalent MOL file
NOHNHCl
Phenol

Properties

Molecular formula
C5H7ClN2O
Molar mass
146.57 g/mol
Exact mass
146.0247 Da
Melting point
246 °C (decomposes)
logP
0.91Crippen estimate
Polar surface area
46.0 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 49 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
5348-51-6
SMILES
Cc1ccnc(O)n1.Cl
InChIKey
FDRYQDWXFZBBAD-UHFFFAOYSA-N
InChI
InChI=1S/C5H6N2O.ClH/c1-4-2-3-6-5(8)7-4;/h2-3H,1H3,(H,6,7,8);1H

Weigh it out

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

Names and synonyms

6 names
  • 2(1H)-Pyrimidinone, 6-methyl-, hydrochloride (1:1)
  • 2(1H)-Pyrimidinone, 4-methyl-, monohydrochloride
  • 2-Hydroxy-4-methylpyrimidine hydrochloride
  • 4-Methyl-2(1H)-pyrimidinone hydrochloride
  • 4-Methyl-1H-pyrimidin-2-one hydrochloride
  • 4-Methylpyrimidin-2-ol hydrochloride

Work with 4-Methyl-2-pyrimidinol monohydrochloride

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-Hydroxy-4,6-dimethylpyrimidine hydrochloride34289-60-657 % similar 2-Mercapto-4-methylpyrimidine hydrochloride6959-66-655 % similar Uracil66-22-854 % similar 2-Chloro-4-methylpyrimidine13036-57-247 % similar 4-Thiouracil591-28-647 % similar 2-Hydroxy-4,6-dimethylpyrimidine108-79-246 % similar 2-Pyrimidinone hydrochloride38353-09-246 % similar 2-Bromo-4-methylpyrimidine130645-48-645 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Amino-2-pyridinol hydrochloride, 95117865-72-2 4-Pyridinol, 2-amino-, hydrochloride (1:1)1187932-09-7 6-Amino-pyridin-3-ol hydrochloride856965-37-2

Elsewhere

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