2-(4-Chlorophenyl)pyrimidin-5-ol

HCID 59322178

Notes Reactions

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Basic information

Standard SMILES: Oc1cnc(-c2ccc(Cl)cc2)nc1
InChIKey: AGBPUVKVIOFCLH-UHFFFAOYSA-N
Molecular formula: C10H7ClN2O
Average molar mass: 206.63 g/mol

Names & identifiers

Preferred name: 2-(4-Chlorophenyl)pyrimidin-5-ol
IUPAC: 2-(4-chlorophenyl)pyrimidin-5-ol

Names & synonyms

2-(4-chlorophenyl)pyrimidin-5-ol157978-08-02-(4-Chloro-phenyl)-pyrimidin-5-olSCHEMBL2434792AGBPUVKVIOFCLH-UHFFFAOYSA-N2-(4-Chlorophenyl)-5-pyrimidinol2-(4-Chlorophenyl)-pyrimidin-5-olDB-422084A1-26496

Database identifiers

PubChem CID: 59322178

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 46 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 14
Formal charge: 0
Complexity: 175

Related reactions

8 records

New reaction record

HRID 103229As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 700749As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 2060252As productuspto-grants-2012_10

HRID 2060257As reactantuspto-grants-2012_10

HRID 2060279As reactantuspto-grants-2012_10

HRID 2060282As reactantuspto-grants-2012_10

HRID 2131500As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

HRID 2314617As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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