Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1)
TL;DR: Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1) (CAS 9009-22-7) is a chemical compound with molecular formula C18H27O6P and molecular weight 370.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol;phosphoric acid
Also Known As: Estradurin, Estradurine, Polyestradiol phosphate, Polyestradioli phosphas, Poly(estradiol phosphate)
| Molecular Formula | C18H27O6P |
|---|---|
| Molecular Weight | 370.15 g/mol |
| LogP | 2.68 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 370.1545 |
| Heavy Atoms | 25 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 9009-22-7 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O.OP(=O)(O)O |
| InChIKey | DGPHKOYFSODERC-CMZLOHJFSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1) (CAS 9009-22-7), with molecular formula C18H27O6P and molecular weight 370.15 g/mol. IUPAC: (8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol;phosphoric acid.
Chemical Property Profile of Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1)
Property Insights of Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1)
The XLogP value of 2.68 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1). The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1). Following Lipinski's Rule of Five, Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1) has 5 hydrogen bond donor(s) and 6 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 Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1)?
The CAS number of Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1) is 9009-22-7.
What is the molecular formula of Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1)?
The molecular formula of Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1) is C18H27O6P.
What is the molecular weight of Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1)?
The molecular weight of Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1) is 370.15 g/mol.
Where can I buy Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1)?
You can request a quote for Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid--estra-1(10),2,4-triene-3,17-diol (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.