![1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether structure](/static/products/6926/69260-14-6.webp)
1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether
TL;DR: 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether (CAS 69260-14-6) is a chemical compound with molecular formula C20H26O5 and molecular weight 346.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(16,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]acetic acid
Also Known As: Estriol-3-carboxymethyl ether, 4-CHLORO-2,6-DIFLUOROBENZYLALCOHOL, 1,3,5[10]-ESTRATRIENE-3,16ALPHA,17BETA-TRIOL 3-CARBOXYMETHYL ETHER, 2-[(16,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]acetic acid
| Molecular Formula | C20H26O5 |
|---|---|
| Molecular Weight | 346.18 g/mol |
| LogP | 2.3378 |
| Topological Polar Surface Area | 86.99 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.178 |
| Heavy Atoms | 25 |
| Complexity | 686.6641 |
Chemical Identifiers
| CAS Number | 69260-14-6 |
|---|---|
| SMILES | CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)OCC(=O)O |
Product Overview
1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether (CAS 69260-14-6), with molecular formula C20H26O5 and molecular weight 346.18 g/mol. IUPAC: 2-[(16,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]acetic acid.
Chemical Property Profile of 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether
Property Insights of 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether
The XLogP value of 2.3378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether. The TPSA of 86.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether. Following Lipinski's Rule of Five, 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether has 3 hydrogen bond donor(s) and 4 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 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether?
The CAS number of 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether is 69260-14-6.
What is the molecular formula of 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether?
The molecular formula of 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether is C20H26O5.
What is the molecular weight of 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether?
The molecular weight of 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether is 346.18 g/mol.
Where can I buy 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether?
You can request a quote for 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5[10]-Estratriene-3,16alpha,17beta-triol 3-carboxymethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.