4-(2',3'-Dimethoxyphenyl) 3-phenylbutyric acid

HCID 12478543
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Basic information

Standard SMILES
COc1cccc(CC(CC(=O)O)c2ccccc2)c1OC
InChIKey
SGIMBXDQRCLVPQ-UHFFFAOYSA-N
Molecular formula
C18H20O4
Average molar mass
300.3 g/mol

Names & identifiers

Preferred name
4-(2',3'-Dimethoxyphenyl) 3-phenylbutyric acid
IUPAC
4-(2,3-dimethoxyphenyl)-3-phenylbutanoic acid

Names & synonyms

SCHEMBL7315266SGIMBXDQRCLVPQ-UHFFFAOYSA-N4-(2',3'-Dimethoxyphenyl) 3-phenylbutyric acid4-(2',3'-Dimethoxyphenyl)-3-phenylbutyric acid

Database identifiers

PubChem CID
12478543

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
55.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
22

Related reactions

16 records
New reaction record

Linked notes

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