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Cholesteryl chloride Structure

Cholesteryl chloride

Chemical Properties

Melting point 94-96 °C (lit.)
alpha  -30 º (c=1, chloroform)
Boiling point 488.29°C (rough estimate)
Density  0.9160 (rough estimate)
refractive index  1.6281 (estimate)
storage temp.  Store below +30°C.
optical activity [α]25/D 24°, c = 1 in chloroform
BRN  2703655
InChIKey OTVRYZXVVMZHHW-DPAQBDIFSA-N
SMILES [C@@]12([H])CC[C@H]([C@H](C)CCCC(C)C)[C@@]1(C)CC[C@]1([H])[C@@]3(C)CC[C@H](Cl)CC3=CC[C@@]21[H] |&1:0,4,5,13,17,19,23,29,r|
LogP 11.576 (est)
CAS DataBase Reference 910-31-6(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 39EHZ05V39
NIST Chemistry Reference Cholest-5-ene, 3beta-chloro(910-31-6)
EPA Substance Registry System Cholest-5-ene, 3-chloro-, (3.beta.)- (910-31-6)

Safety

Safety Statements  22-24/25
WGK Germany  3
TSCA  Yes
HS Code  29035990
NFPA 704:
0
1 0

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