Cholesteryl bromide

• Catalog Number: ACM516916
• Product Name: Cholesteryl bromide
• CAS: 516-91-6
• Category: Steroidal Compounds
• Synonyms: (3beta)-cholest-5-en;3-bromo-,(3.beta.)-Cholest-5-ene;CHOLESTERYL BROMIDE;5-CHOLESTENE-3-BETA-BROMO;3BETA-BROMO-5-CHOLESTENE;3beta-bromocholest-5-ene;3β-Bromo-5-cholestene;Cholesteryl Bromide from Beef Fat
• IUPAC Name: (3S,8S,9S,10R,13R,14S,17R)-3-bromo-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]phenanthrene
• Molecular Weight: 449.55
• Molecular Formula: C₂₇H₄₅Br
• Canonical SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)Br)C)C
• InChI Key: WDRGNJZPWVRVSN-DPAQBDIFSA-N
• Boiling Point: 486ºC at 760mmHg
• Flash Point: 244.1ºC
• Density: 1.1g/cm³
• EC Number: 208-227-9
• Exact Mass: 448.27000
• WGK Germany: 3

Custom Q&A

What is the molecular formula of cholesteryl bromide?

The molecular formula of cholesteryl bromide is C27H45Br.

What is the molecular weight of cholesteryl bromide?

The molecular weight of cholesteryl bromide is 449.5 g/mol.

What is the CAS number of cholesteryl bromide?

The CAS number of cholesteryl bromide is 516-91-6.

What is the IUPAC name of cholesteryl bromide?

The IUPAC name of cholesteryl bromide is (3S,8S,9S,10R,13R,14S,17R)-3-bromo-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]phenanthrene.

What is the InChIKey of cholesteryl bromide?

The InChIKey of cholesteryl bromide is WDRGNJZPWVRVSN-DPAQBDIFSA-N.

What is the XLogP3-AA value of cholesteryl bromide?

The XLogP3-AA value of cholesteryl bromide is 10.

How many hydrogen bond donor counts does cholesteryl bromide have?

Cholesteryl bromide has 0 hydrogen bond donor counts.

How many rotatable bond counts does cholesteryl bromide have?

Cholesteryl bromide has 5 rotatable bond counts.

What is the exact mass of cholesteryl bromide?

The exact mass of cholesteryl bromide is 448.27046 g/mol.

How many defined atom stereocenter counts does cholesteryl bromide have?

Cholesteryl bromide has 8 defined atom stereocenter counts.