AC1OC7KP structure

AC1OC7KP

(2Z,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)-4,5-ditritionona-2,4,6,8-tetraenoic acid

Also Known As: Isotretinoin Retinoic acid|Retinoic-11,12-t2 acid|11,12-3H-Retinoic acid|(11,12-3H2)Retinoic acid|all-trans-(11,12-3H2)Retinoic acid|(2Z,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)-4,5-ditritionona-2,4,6,8-tetraenoic acid

CAS: 66052-75-3
Molecular Formula C20H28O2
Molecular Weight 304.22537 g/mol
LogP 5.6026
Topological Polar Surface Area 37.3 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
Rotatable Bonds 5
Exact Mass 304.22537
Monoisotopic Mass 304.22537
Heavy Atoms 22
Complexity 659.12634

Chemical Identifiers

CAS Number 66052-75-3
SMILES [3H]\C(=C(\[3H])/C(=C\C(=O)O)/C)\C=C(\C)/C=C/C1=C(CCCC1(C)C)C

Product Overview

AC1OC7KP (CAS 66052-75-3), with molecular formula C20H28O2 and molecular weight 304.22537 g/mol. IUPAC: (2Z,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)-4,5-ditritionona-2,4,6,8-tetraenoic acid.

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