3-[5-(Phenylmethyl)-1,2,4-oxadiazol-3-yl]propanal

HCID 86643113
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Basic information

Standard SMILES
O=CCCc1noc(Cc2ccccc2)n1
InChIKey
FVMLZQUZCSEUIG-UHFFFAOYSA-N
Molecular formula
C12H12N2O2
Average molar mass
216.24 g/mol

Names & identifiers

Preferred name
3-[5-(Phenylmethyl)-1,2,4-oxadiazol-3-yl]propanal
IUPAC
3-(5-benzyl-1,2,4-oxadiazol-3-yl)propanal

Names & synonyms

SCHEMBL837228FVMLZQUZCSEUIG-UHFFFAOYSA-N3-[5-(phenylmethyl)-1,2,4-oxadiazol-3-yl]propanal

Database identifiers

PubChem CID
86643113

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
56 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
16

Related reactions

4 records
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Compound notes

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