4-Methylpyrimidin-2-ol hydrochloride

C₅H₆N₂OCAS 15231-48-8110.12 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₆N₂O
Molar mass: 110.12 g/mol
Exact mass: 110.0480 Da
logP: 0.08Crippen estimate
Polar surface area: 45.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation95.9% of notifiers

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

15231-48-8

SMILES

CC1=CC=NC(=O)N1

InChIKey

AHHHDTLXONDKQF-UHFFFAOYSA-N

InChI

InChI=1S/C5H6N2O/c1-4-2-3-6-5(8)7-4/h2-3H,1H3,(H,6,7,8)

Weigh it out

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

Names and synonyms

1 names

2-Hydroxy-4-methylpyrimidine

Work with 4-Methylpyrimidin-2-ol 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

Similar compounds

2-Hydroxy-4-(trifluoromethyl)pyrimidine104048-92-247 % similar N4-Acetylcytosine14631-20-044 % similar 2-Methyl-1,4-dihydropyrimidin-4-one19875-04-842 % similar 2,5-Dimethylpyrrole625-84-342 % similar 6-Methylpyridin-2-ol91914-07-740 % similar 3-Bromo-2-hydroxy-6-picoline374633-33-736 % similar 7-Chloro-2-methyl-1H-pyrrolo[2,3-C]pyridine874013-97-535 % similar 2,6-Dimethyl-4-pyridinol13603-44-634 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Methyl-1H-pyrazole-4-carbaldehyde112758-40-4 6-Methylpyridazin-3(2H)-one13327-27-0 1-Methyl-2-imidazolecarboxaldehyde13750-81-7 3-Hydroxypentanedinitrile13880-89-2 2-Aminopyridine N-oxide14150-95-9 2-Amino-3-hydroxypyridine16867-03-1 1-Methyl-1H-imidazole-4-carbaldehyde17289-26-8 5-Methylpyrimidin-4-ol17758-52-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook