4-(3-Fluorophenyl)-6-(2-butynyloxy)pyrimidine

HCID 22599720
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Basic information

Standard SMILES
CC#CCOc1cc(-c2cccc(F)c2)ncn1
InChIKey
ZYUHEQYJDUKKLU-UHFFFAOYSA-N
Molecular formula
C14H11FN2O
Average molar mass
242.25 g/mol

Names & identifiers

Preferred name
4-(3-Fluorophenyl)-6-(2-butynyloxy)pyrimidine
IUPAC
4-but-2-ynoxy-6-(3-fluorophenyl)pyrimidine

Names & synonyms

SCHEMBL5412658ZYUHEQYJDUKKLU-UHFFFAOYSA-N4-(3-fluorophenyl)-6-(2-butynyloxy)pyrimidine

Database identifiers

PubChem CID
22599720

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
35 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
18

Related reactions

3 records
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Compound notes

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