2232-16-8

Basic information

• Product Name: 10a,12a-dimethyl-2-oxo-1,2,3,4,4a,4b,5,7,8,9,10,10a,10b,11,12,12a-hexadecahydronaphtho[2,1-f]quinolin-8-yl acetate
• Synonyms: CHAND-002
• CAS NO: 2232-16-8
• Molecular Formula: C₂₁H₃₁NO₃
• Molecular Weight: 345.4757
• Mol File: 2232-16-8.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 496.8°C at 760 mmHg
• Flash Point: 254.3°C
• Density: 1.14g/cm³
• Vapor Pressure: 5.22E-10mmHg at 25°C
• Refractive Index: 1.549
• CAS DataBase Reference: 10a,12a-dimethyl-2-oxo-1,2,3,4,4a,4b,5,7,8,9,10,10a,10b,11,12,12a-hexadecahydronaphtho[2,1-f]quinolin-8-yl acetate(CAS DataBase Reference)
• NIST Chemistry Reference: 10a,12a-dimethyl-2-oxo-1,2,3,4,4a,4b,5,7,8,9,10,10a,10b,11,12,12a-hexadecahydronaphtho[2,1-f]quinolin-8-yl acetate(2232-16-8)
• EPA Substance Registry System: 10a,12a-dimethyl-2-oxo-1,2,3,4,4a,4b,5,7,8,9,10,10a,10b,11,12,12a-hexadecahydronaphtho[2,1-f]quinolin-8-yl acetate(2232-16-8)

Safety Data

• Hazardous Substances Data: 2232-16-8(Hazardous Substances Data)

Usage

Chemical structure

A complex chemical compound with a hexadecahydronaphthoquinolin core and an attached acetate group.

Functional groups

Contains an acetate ester functional group, which suggests potential applications in drug delivery or as a precursor for the synthesis of other compounds.

Molecular weight

Approximately 421.58 g/mol (calculated from the molecular formula)

Stereochemistry

The compound has multiple stereocenters, which may result in different stereoisomers with varying properties and activities.

Stability

The stability of the compound would depend on factors such as temperature, pH, and exposure to light or air. The presence of the acetate group may also affect the stability.

Reactivity

The compound may undergo reactions such as hydrolysis, esterification, or other reactions involving the acetate group, depending on the reaction conditions.

Potential applications

Due to its complex structure and the presence of the acetate group, this compound may have potential applications in the pharmaceutical and chemical industries.

Further analysis

A detailed analysis and study of the compound's structure and properties would be required to fully understand its potential applications and limitations.

Upstream product

• 65732-71-0 3β-Acetoxy-17-acetamido-5,16-androstadiene 
• 37413-93-7 3β,21-diacetoxypregna-5,16-dien-20-one 
• 106294-20-6 (Z)-3β-acetoxy-17-hydroxyiminoandrost-5-ene 
• 75980-86-8 3β-acetoxyandrost-5-en-17-one acetylhydrazone 
• 979-02-2 16-dehydropregnenolone acetate 
• 36016-40-7 mesitylenesulfonylhydroxylamine 

Downstream Products

• 1600-81-3 (10aR,12aS)-10a,12a-dimethyl-4,4a,4b,5,6,9,10,10a,10b,11,12,12a-dodecahydronaphtho[2,1-f]quinoline-2,8(1H,3H)-dione 

Relevant articles and documents

TRANSFORMED STEROIDS COMMUNICATION 134. A NEW REGIOSELECTIVE REARRANGEMENT OF Δ16-STEROIDS INTO D-HOMOAZAANDROSTANES

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Photo-induced Transformations. Part 44. Formation of Lactams in the Photolysis of Some Steroidal Acetylhydrazones in the Presence of Oxygen

Irradiation of 3α-acetoxy-5α-androstan-17-one acetylhydrazone (3) or 3β-acetoxyandrost-5-en-17-one acetylhydrazone (5) in dioxan in the presence of oxygen afforded 17-oxo-17a-aza-D-homosteroid and its 13α-isomer , while when oxygen was excluded none of these lactams were formed under otherwise similar conditions. 5α-Cholestan-6-one acetylhydrazone (20) under similar conditions also afforded very low yields of 6-aza-D-homo-5α-cholestan-7-one (21) and 7-aza-B-homo-5α-cholestan-6-one (22) upon photolysis.In contrast with the acetylhydrazones, the corresponding hydrazone (2), upon photolysis in dioxan without the exclusion of oxygen, afforded the corresponding azine (13) without any accompanying lactams .There is a distinct difference in behaviour between the hydrazones and the N-acetyl derivatives towards oxygen under irradiation.Although as yet no definite conclusion can be drawn on the mechanism of lactam formation, some plausible paths are discussed.