环己甲酸雌二醇
TL;DR: 环己甲酸雌二醇 (CAS 15140-27-9) is a chemical compound with molecular formula C25H34O3 and molecular weight 382.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环己甲酸雌二醇
(3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) cyclohexanecarboxylate
Also Known As: estradiol hexahydrobenzoate, 4-O-C14-DDGL, 4-O-Tetradecanoyl-2,3-dideoxyglucono-1,5-lactone, 3-hydroxyestra-1,3,5(10)-trien-17-yl cyclohexanecarboxylate, 2,3-Dideoxy-D-erythro-Hexonic acid delta-lactone, 5-tetradecanoate
| Molecular Formula | C25H34O3 |
|---|---|
| Molecular Weight | 382.25 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.2508 |
| Heavy Atoms | 28 |
| Complexity | 582.0 |
Chemical Identifiers
| CAS Number | 15140-27-9 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2OC(=O)C4CCCCC4)CCC5=C3C=CC(=C5)O |
| InChIKey | IVRCALGRJCHPRV-UHFFFAOYSA-N |
Product Overview
环己甲酸雌二醇 (CAS 15140-27-9), with molecular formula C25H34O3 and molecular weight 382.25 g/mol. IUPAC: (3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) cyclohexanecarboxylate.
Chemical Property Profile of 环己甲酸雌二醇
Property Insights of 环己甲酸雌二醇
The XLogP value of 6.7 indicates that 环己甲酸雌二醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 环己甲酸雌二醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 环己甲酸雌二醇 has 1 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 环己甲酸雌二醇?
The CAS number of 环己甲酸雌二醇 is 15140-27-9.
What is the molecular formula of 环己甲酸雌二醇?
The molecular formula of 环己甲酸雌二醇 is C25H34O3.
What is the molecular weight of 环己甲酸雌二醇?
The molecular weight of 环己甲酸雌二醇 is 382.25 g/mol.
Where can I buy 环己甲酸雌二醇?
You can request a quote for 环己甲酸雌二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环己甲酸雌二醇?
Yes, KEHONG BIO provides custom synthesis services for 环己甲酸雌二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.