3-Buten-2-one, 4-(2,3,4-trimethoxyphenyl)-

HCID 609586
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Basic information

Standard SMILES
COc1ccc(C=CC(C)=O)c(OC)c1OC
InChIKey
CDWROTZMPJSYFY-UHFFFAOYSA-N
Molecular formula
C13H16O4
Average molar mass
236.26 g/mol

Names & identifiers

Preferred name
3-Buten-2-one, 4-(2,3,4-trimethoxyphenyl)-
IUPAC
4-(2,3,4-trimethoxyphenyl)but-3-en-2-one

Names & synonyms

119101-22-33-Buten-2-one, 4-(2,3,4-trimethoxyphenyl)-SCHEMBL1881561AKOS017414339

Database identifiers

PubChem CID
609586

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
17

Related reactions

2 records
New reaction record

Compound notes

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