methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate
TL;DR: methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate (CAS 701286-50-2) is a chemical compound with molecular formula C16H18O5 and molecular weight 290.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-methyl-2-oxo-7-propan-2-yloxychromen-3-yl)acetate
Also Known As: EiM07-16676, methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate, methyl [4-methyl-2-oxo-7-(propan-2-yloxy)-2H-chromen-3-yl]acetate, methyl 2-(4-methyl-2-oxo-7-propan-2-yloxychromen-3-yl)acetate, methyl 2-(7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate
| Molecular Formula | C16H18O5 |
|---|---|
| Molecular Weight | 290.12 g/mol |
| LogP | 2.60412 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 290.11542 |
| Heavy Atoms | 21 |
| Complexity | 727.26013 |
Chemical Identifiers
| CAS Number | 701286-50-2 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2)OC(C)C)CC(=O)OC |
Product Overview
methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate (CAS 701286-50-2), with molecular formula C16H18O5 and molecular weight 290.12 g/mol. IUPAC: methyl 2-(4-methyl-2-oxo-7-propan-2-yloxychromen-3-yl)acetate.
Chemical Property Profile of methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate
Property Insights of methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate
The XLogP value of 2.60412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate. Following Lipinski's Rule of Five, methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate has 0 hydrogen bond donor(s) and 5 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 methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate?
The CAS number of methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate is 701286-50-2.
What is the molecular formula of methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate?
The molecular formula of methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate is C16H18O5.
What is the molecular weight of methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate?
The molecular weight of methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate is 290.12 g/mol.
Where can I buy methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate?
You can request a quote for methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl (7-isopropoxy-4-methyl-2-oxo-2H-chromen-3-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.