6,7-Dimethoxy-4-methylcoumarin
TL;DR: 6,7-Dimethoxy-4-methylcoumarin (CAS 4281-40-7) is a chemical compound with molecular formula C12H12O4 and molecular weight 220.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethoxy-4-methylchromen-2-one
Also Known As: 6,7-Dimethoxy-4-methylcoumarin, 6,7-Dimethoxy-4-methyl-2H-chromen-2-one, 4-Methyl-6,7-dimethoxycoumarin, 6,7-dimethoxy-4-methylchromen-2-one, Coumarin, 6,7-dimethoxy-4-methyl-
| Molecular Formula | C12H12O4 |
|---|---|
| Molecular Weight | 220.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.07356 |
| Heavy Atoms | 16 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 4281-40-7 |
|---|---|
| SMILES | CC1=CC(=O)OC2=CC(=C(C=C12)OC)OC |
| InChIKey | GBYDSYPGGDKWGZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6,7-Dimethoxy-4-methylcoumarin (CAS 4281-40-7), with molecular formula C12H12O4 and molecular weight 220.07 g/mol. IUPAC: 6,7-dimethoxy-4-methylchromen-2-one.
Chemical Property Profile of 6,7-Dimethoxy-4-methylcoumarin
Property Insights of 6,7-Dimethoxy-4-methylcoumarin
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dimethoxy-4-methylcoumarin. With a topological polar surface area (TPSA) of 44.8 Ų, 6,7-Dimethoxy-4-methylcoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Dimethoxy-4-methylcoumarin has 0 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 6,7-Dimethoxy-4-methylcoumarin?
The CAS number of 6,7-Dimethoxy-4-methylcoumarin is 4281-40-7.
What is the molecular formula of 6,7-Dimethoxy-4-methylcoumarin?
The molecular formula of 6,7-Dimethoxy-4-methylcoumarin is C12H12O4.
What is the molecular weight of 6,7-Dimethoxy-4-methylcoumarin?
The molecular weight of 6,7-Dimethoxy-4-methylcoumarin is 220.07 g/mol.
Where can I buy 6,7-Dimethoxy-4-methylcoumarin?
You can request a quote for 6,7-Dimethoxy-4-methylcoumarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dimethoxy-4-methylcoumarin?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dimethoxy-4-methylcoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.