3-Oxoandrost-4-en-17-yl octanoate
TL;DR: 3-Oxoandrost-4-en-17-yl octanoate (CAS 29430-22-6) is a chemical compound with molecular formula C27H42O3 and molecular weight 414.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl) octanoate
Also Known As: testosterone octanoate, Epitestosterone, octanoate, 3-oxoandrost-4-en-17-yl octanoate, 17beta-Hydroxyandrost-4-en-3-one octanoate, (10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl) octanoate
| Molecular Formula | C27H42O3 |
|---|---|
| Molecular Weight | 414.31 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 414.3134 |
| Heavy Atoms | 30 |
| Complexity | 694.0 |
Chemical Identifiers
| CAS Number | 29430-22-6 |
|---|---|
| SMILES | CCCCCCCC(=O)OC1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C |
| InChIKey | KCQOWSKVHVGCCF-UHFFFAOYSA-N |
Product Overview
3-Oxoandrost-4-en-17-yl octanoate (CAS 29430-22-6), with molecular formula C27H42O3 and molecular weight 414.31 g/mol. IUPAC: (10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl) octanoate.
Chemical Property Profile of 3-Oxoandrost-4-en-17-yl octanoate
Property Insights of 3-Oxoandrost-4-en-17-yl octanoate
The XLogP value of 6.9 indicates that 3-Oxoandrost-4-en-17-yl octanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 3-Oxoandrost-4-en-17-yl octanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Oxoandrost-4-en-17-yl octanoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Oxoandrost-4-en-17-yl octanoate?
The CAS number of 3-Oxoandrost-4-en-17-yl octanoate is 29430-22-6.
What is the molecular formula of 3-Oxoandrost-4-en-17-yl octanoate?
The molecular formula of 3-Oxoandrost-4-en-17-yl octanoate is C27H42O3.
What is the molecular weight of 3-Oxoandrost-4-en-17-yl octanoate?
The molecular weight of 3-Oxoandrost-4-en-17-yl octanoate is 414.31 g/mol.
Where can I buy 3-Oxoandrost-4-en-17-yl octanoate?
You can request a quote for 3-Oxoandrost-4-en-17-yl octanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Oxoandrost-4-en-17-yl octanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-Oxoandrost-4-en-17-yl octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.