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Cholesteryl benzoate
Catalog Number
604-32-0
CAS
604-32-0
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] benzoate
Synonyms
3-Benzoyloxycholest-5-ene; 3-Hydroxycholest-5-ene3-benzoate; Cholest-5-en-3-ol (3beta)-, benzoate; Cholest-5-en-3-ol(3.beta.)-,benzoate; Cholest-5-en-3-yl benzoate; Cholest-5-ene-3-ol3-benzoate; CHOLESTERYL BENZOATE; CHOLESTEROL BENZOATE
Application
Pharmaceutic aid (emulsifying agent).
Molecular Weight
490.77
Molecular Formula
C34H50O2
Product Information
Purity
>96.0%(GC)
MDL
MFCD00003635
Physical State
Solid
Appearance
White Solid
Melting Point
150 °C
Density
1.04 g/cm3
Optical Activity
-10°, c = 5 in THF
Safety Information
WGK Germany
3
Canonical SMILES
O=C(O[C@@H]1CC2=CC[C@]3([H])[C@@](CC[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)CCCC(C)C)([H])[C@@]2(C)CC1)C5=CC=CC=C5
InChI
InChI=1S/C34H50O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-14,23-24,27-31H,9-11,15-22H2,1-5H3/t24-,27+,28+,29-,30+,31+,33+,34-/m1/s1
InChI Key
UVZUFUGNHDDLRQ-LLHZKFLPSA-N
