CAS 14914-99-9 Cholesteryl hydrocinnamate - Materials / Alfa Chemistry

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Cholesteryl hydrocinnamate

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Catalog Number

ACM14914999-1

Product Name

Cholesteryl hydrocinnamate

Structure

CAS

14914-99-9

Category

Liquid Crystal (LC) Materials

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] 3-phenylpropanoate

Molecular Weight

518.8g/mol

Molecular Formula

C36H54O2

Canonical SMILES

CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)CCC5=CC=CC=C5)C)C

InChI

InChI=1S/C36H54O2/c1-25(2)10-9-11-26(3)31-17-18-32-30-16-15-28-24-29(38-34(37)19-14-27-12-7-6-8-13-27)20-22-35(28,4)33(30)21-23-36(31,32)5/h6-8,12-13,15,25-26,29-33H,9-11,14,16-24H2,1-5H3/t26-,29+,30+,31-,32+,33+,35+,36-/m1/s1

InChI Key

KPNKAGLPVPTLGB-ZOJFKXTHSA-N

Complexity

836

Covalently-Bonded Unit Count

EC Number

238-983-5

Exact Mass

518.412381g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass