Cholesteryl chloroacetate

[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-chloroacetate

Also Known As: cholesterol chloroacetate|Cholesteryl chloroacetate|Cholesterolchloroacetate|3Beta-chloroacetoxycholest-5-ene|EINECS 222-415-8|Cholest-5-ene-3-beta-yl chloroacetate|3beta-(Chloroacetoxy)cholesta-5-ene|Cholest-5-en-3beta-ol chloroacetate|3.beta.-(Chloroacetoxy)cholest-5-ene|Cholest-5-en-3-ol (3.beta.)-, chloroacetate|3-BETA-HYDROXY-5-CHOLESTENE 3-CHLOROACETATE|[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] 2-chloroacetate|(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl 2-chloroacetate|(1R,3aS,3bS,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl 2-chloroacetate|(1S,2R,5S,10S,11S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-en-5-yl 2-chloroacetate|(1S,2R,5S,10S,11S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.02,7.011,15]heptadec-7-en-5-yl 2-chloroacetate

Molecular Formula	C29H47ClO2
Molecular Weight	462.32645 g/mol
LogP	8.18
Topological Polar Surface Area	26.3 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	7
Exact Mass	462.32645
Heavy Atoms	32
Complexity	713.9

Chemical Identifiers

CAS Number	3464-50-4
SMILES	C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)CCl)C)C