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Cholesteryl stearate
Catalog Number
35602-69-8
CAS
35602-69-8
IUPAC Name
[(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] octadecanoate
Synonyms
Cholest-5-en-3-ol (3β)-, 3-octadecanoate; Cholest-5-en-3-ol (3β)-, octadecanoate; Cholesterol, stearate; Stearic acid, cholesteryl ester; CE(18:0); Cholesterol n-octanoate; Cholesteryl octadecanoate; Nikkol Cholesteryl Stearate; NSC 59693
Molecular Weight
653.12
Molecular Formula
C45H80O2
Product Information
Purity
≥95%
MDL
MFCD00003639
Physical State
Solid
Appearance
white powder
Storage
Store at -20°C
Boiling Point
671.7±34.0°C at 760 mmHg
Melting Point
82.5°C
Flash Point
360.6°C
Density
0.95±0.1 g/cm3
Optical Activity
[α]25/D −21°, c = 2 in chloroform
Refractive Index
1.505
Safety Information
Precautionary Statement
P262
TSCA
No
WGK Germany
3
Canonical SMILES
CCCCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
InChI
InChI=1S/C45H80O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1
InChI Key
XHRPOTDGOASDJS-XNTGVSEISA-N
