12-Chlorodehydroabietic acid

(1R,4aS,10aR)-6-chloro-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid

Also Known As: 12-Chlorodehydroabietic acid|Chlorodehydroabietic|12-Chlorodehydroabietic acide|12-Chloroabieta-8,11,13-trien-18-oic acid|1,3,4-Thiadiazolium, 2-amino-3-methyl-, iodide|12-Chloroabieta-8(14),9(11),12-trien-18-oic acid|(1R,4aS,10aR)-6-chloro-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid|1-Phenanthrenecarboxylic acid, 6-chloro-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R,4aS,10aR)-|1-Phenanthrenecarboxylic acid, 6-chloro-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-, (1R-(1alpha,4abeta,10aalpha))-|1-phenanthrenecarboxylic acid, 6-chloro-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-,(1r,4as,10ar)-|(1R,4aS,10aR)-6-chloro-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthrene-1-carboxylic acid

Molecular Formula	C20H27ClO2
Molecular Weight	334.16995 g/mol
LogP	5.56
Topological Polar Surface Area	37.3 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	1
Rotatable Bonds	2
Exact Mass	334.16995
Heavy Atoms	23
Complexity	651.3

Chemical Identifiers

CAS Number	65310-45-4
SMILES	CC(C)C1=C(C=C2C(=C1)CC[C@@H]3[C@@]2(CCC[C@@]3(C)C(=O)O)C)Cl