(2E,4E,6Z,8E)-3-methyl-7-(4-methylphenyl)-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid

(2E,4E,6Z,8E)-3-methyl-7-(4-methylphenyl)-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid

CAS: 160162-42-5

Formula: C26H32O2

SMILES: CC(C=CC=C(C=CC1=C(C)CCCC1(C)C)/C1=CC=C(C)C=C1)=C/C(O)=O

IUPAC: (2E,4E,6Z,8E)-3-methyl-7-(4-methylphenyl)-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid

InChI: InChI=1S/C26H32O2/c1-19-11-13-23(14-12-19)22(10-6-8-20(2)18-25(27)28)15-16-24-21(3)9-7-17-26(24,4)5/h6,8,10-16,18H,7,9,17H2,1-5H3,(H,27,28)/b8-6+,16-15+,20-18+,22-10-

Composition: C (82.94%), H (8.57%), O (8.50%)

Molar Mass: 376.54

Atom Count: 60

Heavy Atom Count: 28

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	376.24023027
Formal Charge	0
FSP3	0.35
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	RQANARBNMTXCDM-DKOHIBGUSA-N
Lipinski's Rule of Five
Molar Refractivity	122.93
Topological Polar Surface Area	37.3
Polarizability	45.72
Ring Count	2
Rotatable Bond Count	6

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