3,3-Difao-Ac
TL;DR: 3,3-Difao-Ac (CAS 1827-75-4) is a chemical compound with molecular formula C21H32F2O2 and molecular weight 354.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,3-difluoro-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl) acetate
Also Known As: 3,3-Difao-Ac, 3,3-Difluoroandrostane-17-ol acetate, 3,3-Difluoro-5alpha-androstane-17beta-ol acetate, (3,3-difluoro-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl) acetate
| Molecular Formula | C21H32F2O2 |
|---|---|
| Molecular Weight | 354.24 g/mol |
| LogP | 5.5961 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 354.23703 |
| Heavy Atoms | 25 |
| Complexity | 562.0993 |
Chemical Identifiers
| CAS Number | 1827-75-4 |
|---|---|
| SMILES | CC(=O)OC1CCC2C1(CCC3C2CCC4C3(CCC(C4)(F)F)C)C |
Product Overview
3,3-Difao-Ac (CAS 1827-75-4), with molecular formula C21H32F2O2 and molecular weight 354.24 g/mol. IUPAC: (3,3-difluoro-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl) acetate.
Chemical Property Profile of 3,3-Difao-Ac
Property Insights of 3,3-Difao-Ac
The XLogP value of 5.5961 indicates that 3,3-Difao-Ac is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 3,3-Difao-Ac exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Difao-Ac has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3-Difao-Ac?
The CAS number of 3,3-Difao-Ac is 1827-75-4.
What is the molecular formula of 3,3-Difao-Ac?
The molecular formula of 3,3-Difao-Ac is C21H32F2O2.
What is the molecular weight of 3,3-Difao-Ac?
The molecular weight of 3,3-Difao-Ac is 354.24 g/mol.
Where can I buy 3,3-Difao-Ac?
You can request a quote for 3,3-Difao-Ac directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Difao-Ac?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Difao-Ac and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.