Triphasiol
TL;DR: Triphasiol (CAS 81445-98-9) is a chemical compound with molecular formula C19H24O6 and molecular weight 348.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2,3-dihydroxy-3-methylbutoxy)-8-(3-methyl-2-oxobutyl)chromen-2-one
Also Known As: Triphasiol, 22,25-Dihydroxyvitamin D3, 2H-1-Benzopyran-2-one, 7-(2,3-dihydroxy-3-methylbutoxy)-8-(3-methyl-2-oxobutyl)-, 7-(2,3-dihydroxy-3-methylbutoxy)-8-(3-methyl-2-oxobutyl)-2H-chromen-2-one, 7-(2,3-dihydroxy-3-methylbutoxy)-8-(3-methyl-2-oxobutyl)chromen-2-one
| Molecular Formula | C19H24O6 |
|---|---|
| Molecular Weight | 348.16 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 348.1573 |
| Heavy Atoms | 25 |
| Complexity | 524.0 |
| Melting Point | 85 °C |
Chemical Identifiers
| CAS Number | 81445-98-9 |
|---|---|
| SMILES | CC(C)C(=O)CC1=C(C=CC2=C1OC(=O)C=C2)OCC(C(C)(C)O)O |
| InChIKey | DMSHDRKZHASQRO-UHFFFAOYSA-N |
Product Overview
Triphasiol (CAS 81445-98-9), with molecular formula C19H24O6 and molecular weight 348.16 g/mol. IUPAC: 7-(2,3-dihydroxy-3-methylbutoxy)-8-(3-methyl-2-oxobutyl)chromen-2-one.
Chemical Property Profile of Triphasiol
Property Insights of Triphasiol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triphasiol. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Triphasiol. Following Lipinski's Rule of Five, Triphasiol has 2 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 Triphasiol?
The CAS number of Triphasiol is 81445-98-9.
What is the molecular formula of Triphasiol?
The molecular formula of Triphasiol is C19H24O6.
What is the molecular weight of Triphasiol?
The molecular weight of Triphasiol is 348.16 g/mol.
Where can I buy Triphasiol?
You can request a quote for Triphasiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triphasiol?
Yes, KEHONG BIO provides custom synthesis services for Triphasiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.