Cholesteryl caproate
CAS Registry Number®
1062-96-0
CAS Name
Cholesteryl caproateMolecular Formula
C33H56O2Molecular Mass
484.80Cite this Page
Cholesteryl caproate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1062-96-0 (retrieved ) (CAS RN: 1062-96-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
94.5 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C33H56O2/c1-7-8-9-13-31(34)35-26-18-20-32(5)25(22-26)14-15-27-29-17-16-28(24(4)12-10-11-23(2)3)33(29,6)21-19-30(27)32/h14,23-24,26-30H,7-13,15-22H2,1-6H3/t24-,26+,27+,28-,29+,30+,32+,33-/m1/s1
InChIKey
InChIKey=FPBODWXATDKICU-FLFWOSPYSA-N
SMILES
C[C@@]12[C@@]3([C@]([C@]4([C@](C)(CC3)[C@@]([C@@H](CCCC(C)C)C)(CC4)[H])[H])(CC=C1C[C@@H](OC(CCCCC)=O)CC2)[H])[H]
Canonical SMILES
O=C(OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCCC(C)C)C2(C)CC1)CCCCC
Other Names for this Substance
- Cholest-5-en-3-ol (3β)-, hexanoate
- Cholesterol, hexanoate
- Hexanoic acid, cholesteryl ester
- Cholesteryl caproate
- Cholesterol caproate
Deleted or Replaced CAS Registry Numbers
137036-81-8, 313219-53-3