Phenol, 2-(2-pyrimidinyl)-

Substructure search Find similar structures

Basic information

CAS: 64435-20-7
Standard SMILES: Oc1ccccc1-c1ncccn1
InChIKey: CGDCHTLRDXXNPE-UHFFFAOYSA-N
Molecular formula: C10H8N2O
Average molar mass: 172.18 g/mol
Monoisotopic mass: 172.06366288

Names & identifiers

Preferred name: Phenol, 2-(2-pyrimidinyl)-
IUPAC: 2-pyrimidin-2-ylphenol

Names & synonyms

Phenol, 2-(2-pyrimidinyl)-64435-20-72-(2-Pyrimidinyl)phenol2-(2-Hydroxyphenyl)pyrimidinepyrimidinyl phenolo-hydroxyphenylpyrimidine2-(2-Pyrimidinyl)phenol #Phenol, 2-(2-pyrimidyl)-SCHEMBL679952CHEMBL4448249SCHEMBL16719473SCHEMBL16719475

Show more names

SCHEMBL31551042DTXSID00706176DB-181200SR-01000512652SR-01000512652-16-(Pyrimidin-2(1H)-ylidene)cyclohexa-2,4-dien-1-one

Database identifiers

CAS: 64435-20-7
PubChem CID: 598941
DTXSID: DTXSID00706176
ChEMBL: CHEMBL4448249
Nikkaji: J526.212G

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 46 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 157

Related reactions

1 records

New reaction record

HRID 1255199As productuspto-grants-2013_06

Compound notes

Loading…