Cholesteryl nonanoate

• CAS: 1182-66-7
• Catalog Number: ACM1182667
• Category: Organic & Printed Electronics; Cholesteryl Esters
• Molecular Weight: 526.88
• Molecular Formula: C36H62O2
• Synonyms: Cholest-5-ene-3-beta-yl nonanoate;Cholest-5-en-3-ol (3beta)-, nonanoate
• 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] nonanoate
• Canonical SMILES: CCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C
• InChI: WCLNGBQPTVENHV-MKQVXYPISA-N
• InChI Key: InChI=1S/C36H62O2/c1-7-8-9-10-11-12-16-34(37)38-29-21-23-35(5)28(25-29)17-18-30-32-20-19-31(27(4)15-13-14-26(2)3)36(32,6)24-22-33(30)35/h17,26-27,29-33H,7-16,18-25H2,1-6H3/t27-,29+,30+,31-,32+,33+,35+,36-/m1/s1
• Boiling Point: 360 °C
• Melting Point: 74-77 °C(lit.)
• Flash Point: 300.8ºC
• Density: 0.959g/ml
• Appearance: Powder to crystal
• Active Content: 95%
• CNo.Chain: C9:0
• Compound Derivative: Nonanoate
• Exact Mass: 526.47500
• Physical State: Solid
• Safety Description: S24/25
• Stability: Stable under normal temperatures and pressures.
• WGK Germany: 3

Custom Q&A

What is the molecular formula of cholesteryl pelargonate?

The molecular formula of cholesteryl pelargonate is C36H62O2.

When was cholesteryl pelargonate created and last modified?

Cholesteryl pelargonate was created on July 19, 2005, and last modified on December 2, 2023.

What are some synonyms for cholesteryl pelargonate?

Some synonyms for cholesteryl pelargonate include CHOLESTERYL NONANOATE, Cholesterol pelargonate, and GOnate.

What is the molecular weight of cholesteryl pelargonate?

The molecular weight of cholesteryl pelargonate is 526.9 g/mol.

What is the IUPAC name of cholesteryl pelargonate?

The IUPAC name of cholesteryl pelargonate is [(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] nonanoate.

What is the InChIKey of cholesteryl pelargonate?

The InChIKey of cholesteryl pelargonate is WCLNGBQPTVENHV-MKQVXYPISA-N.

How many hydrogen bond acceptors are in cholesteryl pelargonate?

There are 2 hydrogen bond acceptors in cholesteryl pelargonate.

What is the topological polar surface area of cholesteryl pelargonate?

The topological polar surface area of cholesteryl pelargonate is 26.3 Ų.

How many rotatable bonds are in cholesteryl pelargonate?

There are 14 rotatable bonds in cholesteryl pelargonate.

What is the CAS number for cholesteryl pelargonate?

The CAS number for cholesteryl pelargonate is 1182-66-7.