4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate
TL;DR: 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate (CAS 313470-99-4) is a chemical compound with molecular formula C17H18O6 and molecular weight 318.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-acetyloxy-4-methyl-2-oxo-3-propylchromen-7-yl) acetate
Also Known As: 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate, (5-acetyloxy-4-methyl-2-oxo-3-propylchromen-7-yl) acetate, 7-(ACETYLOXY)-4-METHYL-2-OXO-3-PROPYL-2H-CHROMEN-5-YL ACETATE, ACETIC ACID 5-ACETOXY-4-METHYL-2-OXO-3-PROPYL-2H-CHROMEN-7-YL ESTER
| Molecular Formula | C17H18O6 |
|---|---|
| Molecular Weight | 318.11 g/mol |
| LogP | 2.90452 |
| Topological Polar Surface Area | 82.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 318.11035 |
| Heavy Atoms | 23 |
| Complexity | 831.073 |
Chemical Identifiers
| CAS Number | 313470-99-4 |
|---|---|
| SMILES | CCCC1=C(C2=C(C=C(C=C2OC(=O)C)OC(=O)C)OC1=O)C |
Product Overview
4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate (CAS 313470-99-4), with molecular formula C17H18O6 and molecular weight 318.11 g/mol. IUPAC: (5-acetyloxy-4-methyl-2-oxo-3-propylchromen-7-yl) acetate.
Chemical Property Profile of 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate
Property Insights of 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate
The XLogP value of 2.90452 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate. The TPSA of 82.81 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate. Following Lipinski's Rule of Five, 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate has 0 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 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate?
The CAS number of 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate is 313470-99-4.
What is the molecular formula of 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate?
The molecular formula of 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate is C17H18O6.
What is the molecular weight of 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate?
The molecular weight of 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate is 318.11 g/mol.
Where can I buy 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate?
You can request a quote for 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-2-oxo-3-propyl-2H-chromene-5,7-diyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.