Cholesteryl chloroacetate
CAS Registry Number®
3464-50-4
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CAS Name
Cholesteryl chloroacetateMolecular Formula
C29H47ClO2Molecular Mass
463.14Cite this Page
Cholesteryl chloroacetate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3464-50-4 (retrieved ) (CAS RN: 3464-50-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
162 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C29H47ClO2/c1-19(2)7-6-8-20(3)24-11-12-25-23-10-9-21-17-22(32-27(31)18-30)13-15-28(21,4)26(23)14-16-29(24,25)5/h9,19-20,22-26H,6-8,10-18H2,1-5H3/t20-,22+,23+,24-,25+,26+,28+,29-/m1/s1
InChIKey
InChIKey=XUXXPLDKUZSGKH-OHPSOFBHSA-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(CCl)=O)CC2)[H])[H]
Canonical SMILES
O=C(OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCCC(C)C)C2(C)CC1)CCl
Other Names for this Substance
- Cholest-5-en-3-ol (3β)-, 3-(2-chloroacetate)
- Cholesterol, chloroacetate
- Cholest-5-en-3-ol (3β)-, chloroacetate
- Cholesteryl chloroacetate
- NSC 102806
Deleted or Replaced CAS Registry Numbers
30046-94-7, 121076-42-4, 294853-83-1, 2760344-10-1