(2E,4E,6Z,8E)-3,7-dimethyl-8-(3-phenyl-2-propan-2-ylcyclohex-2-en-1-ylidene)octa-2,4,6-trienoic acid

HCID 11617486

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 245124-79-2
Standard SMILES: CC(=C/C=C/C(C)=C/C(=O)O)/C=C1\CCCC(c2ccccc2)=C1C(C)C
InChIKey: OGPCAFPMTHWNOM-NUXCVKLASA-N
Molecular formula: C25H30O2
Average molar mass: 362.5 g/mol
Monoisotopic mass: 362.2245802

Names & identifiers

Preferred name: (2E,4E,6Z,8E)-3,7-dimethyl-8-(3-phenyl-2-propan-2-ylcyclohex-2-en-1-ylidene)octa-2,4,6-trienoic acid
IUPAC: (2E,4E,6Z,8E)-3,7-dimethyl-8-(3-phenyl-2-propan-2-ylcyclohex-2-en-1-ylidene)octa-2,4,6-trienoic acid

Names & synonyms

CHEMBL3622721DTXSID501111548BDBM50123611245124-79-2(2E,4E,6Z,8E)-3,7-Dimethyl-8-[2-(1-methylethyl)-3-phenyl-2-cyclohexen-1-ylidene]-2,4,6-octatrienoic acid(2E,4E,6Z,8E)-3,7-Dimethyl-8-[2-(propan-2-yl)-5,6-dihydro[1,1'-biphenyl]-3(4H)-ylidene]octa-2,4,6-trienoic acid

Database identifiers

CAS: 245124-79-2
PubChem CID: 11617486
DTXSID: DTXSID501111548
ChEMBL: CHEMBL3622721

Properties

Computed structural properties

XLogP: 6.5
Topological polar surface area: 37.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 6
Heavy atoms: 27
Formal charge: 0
Complexity: 677

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…