Structure

4-Androsten-3,17-dione 19-aldehyde

CAS
968-49-0
Catalog Number
ACM968490
Category
Steroidal Compounds
Molecular Weight
300.39
Molecular Formula
C19H24O3

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Specification

Synonyms
19-ALDOANDROSTENEDIONE;4-ANDROSTEN-3,17-DIONE 19-ALDEHYDE;4-ANDROSTEN-19-AL-3,17-DIONE;4-ANDROSTEN-3,17,19-TRIONE;19-oxo-delta(4) androstene-3,17-dione;19-Oxoandrostenedione;3,17-Dioxoandrost-4-en-19-al;(8R,9S,10S,13S,14S)-13-methyl-3,17-dioxo-2,6,7,8,9,
IUPAC Name
(8R,9S,10S,13S,14S)-13-methyl-3,17-dioxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
SMILES
CC12CCC3C(C1CCC2=O)CCC4=CC(=O)CCC34C=O
InChI Key
XRCFMDPVHKVRDJ-BGJMDTOESA-N
Boiling Point
471.3ºC at 760mmHg
Flash Point
203.7ºC
Density
1.18g/cm³
Exact Mass
300.17300
What is the molecular formula of 4-Androsten-3,17-dione 19-aldehyde?

The molecular formula is C19H24O3.

What is the molecular weight of 4-Androsten-3,17-dione 19-aldehyde?

The molecular weight is 300.4 g/mol.

What is the IUPAC name of 4-Androsten-3,17-dione 19-aldehyde?

The IUPAC name is (8R,9S,10S,13S,14S)-13-methyl-3,17-dioxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde.

What is the InChI of 4-Androsten-3,17-dione 19-aldehyde?

The InChI is InChI=1S/C19H24O3/c1-18-8-7-16-14(15(18)4-5-17(18)22)3-2-12-10-13(21)6-9-19(12,16)11-20/h10-11,14-16H,2-9H2,1H3/t14-,15-,16-,18-,19+/m0/s1.

What is the InChIKey of 4-Androsten-3,17-dione 19-aldehyde?

The InChIKey is XRCFMDPVHKVRDJ-BGJMDTOESA-N.

What is the Canonical SMILES of 4-Androsten-3,17-dione 19-aldehyde?

The Canonical SMILES is CC12CCC3C(C1CCC2=O)CCC4=CC(=O)CCC34C=O.

What is the CAS number of 4-Androsten-3,17-dione 19-aldehyde?

The CAS number is 968-49-0.

What is the UNII of 4-Androsten-3,17-dione 19-aldehyde?

The UNII is X07F7694NW.

What is the topological polar surface area of 4-Androsten-3,17-dione 19-aldehyde?

The topological polar surface area is 51.2 Ų.

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