CAS 7144-08-3 Cholesteryl chloroformate - Materials / Alfa Chemistry

NAVIGATION

Cholesteryl chloroformate

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Catalog Number

ACM7144083

CAS Number

7144-08-3

Product Name

Cholesteryl chloroformate

Structure

Category

Liquid Crystal (LC) Materials

Synonyms

Cholest-5-ene-3-beta-yl chloroformate

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] carbonochloridate

Molecular Weight

449.12

Molecular Formula

C28H45ClO2

Canonical SMILES

C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)Cl)C)C

InChI

InChI=1S/C28H45ClO2/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(31-26(29)30)13-15-27(20,4)25(22)14-16-28(23,24)5/h9,18-19,21-25H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,27+,28-/m1/s1

InChI Key

QNEPTKZEXBPDLF-JDTILAPWSA-N

Boiling Point

556.5 ºC

Melting Point

115-117 ºC (lit.)

Flash Point

203.1ºC

Purity

98%+

Density

0.934 g/ml