![二环[3.2.1]辛烷 structure](/static/products/6221/6221-55-2.webp)
二环[3.2.1]辛烷
TL;DR: 二环[3.2.1]辛烷 (CAS 6221-55-2) is a chemical compound with molecular formula C21H32O2 and molecular weight 316.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二环[3.2.1]辛烷
(5S,8R,9S,10S,13S,14S,17S)-17-hydroxy-2,10,13,17-tetramethyl-5,6,7,8,9,11,12,14,15,16-decahydro-4H-cyclopenta[a]phenanthren-3-one
Also Known As: Methylstenbolone, Ultradrol, Methyl sten, M-STEN, 2,17a-Dimethyl-17b-hydroxy-5a-androst-1-en-3-one
| Molecular Formula | C21H32O2 |
|---|---|
| Molecular Weight | 316.24 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 316.24023 |
| Heavy Atoms | 23 |
| Complexity | 578.0 |
Chemical Identifiers
| CAS Number | 6221-55-2 |
|---|---|
| SMILES | CC1=C[C@]2([C@@H](CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@]4(C)O)C)CC1=O)C |
| InChIKey | TVTSDURKYARCML-IYRCEVNGSA-N |
Product Overview
二环[3.2.1]辛烷 (CAS 6221-55-2), with molecular formula C21H32O2 and molecular weight 316.24 g/mol. IUPAC: (5S,8R,9S,10S,13S,14S,17S)-17-hydroxy-2,10,13,17-tetramethyl-5,6,7,8,9,11,12,14,15,16-decahydro-4H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 二环[3.2.1]辛烷
Property Insights of 二环[3.2.1]辛烷
The XLogP value of 4.5 indicates that 二环[3.2.1]辛烷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 二环[3.2.1]辛烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二环[3.2.1]辛烷 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 二环[3.2.1]辛烷?
The CAS number of 二环[3.2.1]辛烷 is 6221-55-2.
What is the molecular formula of 二环[3.2.1]辛烷?
The molecular formula of 二环[3.2.1]辛烷 is C21H32O2.
What is the molecular weight of 二环[3.2.1]辛烷?
The molecular weight of 二环[3.2.1]辛烷 is 316.24 g/mol.
Where can I buy 二环[3.2.1]辛烷?
You can request a quote for 二环[3.2.1]辛烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二环[3.2.1]辛烷?
Yes, KEHONG BIO provides custom synthesis services for 二环[3.2.1]辛烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.