4-Methoxy-2,5-dimethylcinnamic acid

HCID 5199898
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Basic information

Standard SMILES
COc1cc(C)c(C=CC(=O)O)cc1C
InChIKey
IOIBAKWPAAWBAN-UHFFFAOYSA-N
Molecular formula
C12H14O3
Average molar mass
206.24 g/mol
Monoisotopic mass
206.0942943

Names & identifiers

Preferred name
4-Methoxy-2,5-dimethylcinnamic acid
IUPAC
3-(4-methoxy-2,5-dimethylphenyl)prop-2-enoic acid

Names & synonyms

SCHEMBL2434895IOIBAKWPAAWBAN-UHFFFAOYSA-N4-methoxy-2,5-dimethylcinnamic acid

Database identifiers

PubChem CID
5199898

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
15

Related reactions

8 records
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Compound notes

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