2H-1-Benzopyran-2-one, 3,7-dimethoxy-
TL;DR: 2H-1-Benzopyran-2-one, 3,7-dimethoxy- (CAS 29076-68-4) is a chemical compound with molecular formula C11H10O4 and molecular weight 206.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethoxychromen-2-one
Also Known As: 3,7-Dimethoxycoumarin, Coumarin, 3,7-dimethoxy-, 3,7-dimethoxychromen-2-one, Coumarin-2,7-dimethylether, 2H-1-Benzopyran-2-one, 3,7-dimethoxy-
| Molecular Formula | C11H10O4 |
|---|---|
| Molecular Weight | 206.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.0579 |
| Heavy Atoms | 15 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 29076-68-4 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C=C(C(=O)O2)OC |
| InChIKey | IAFJNCMUCQDWCR-UHFFFAOYSA-N |
Product Overview
2H-1-Benzopyran-2-one, 3,7-dimethoxy- (CAS 29076-68-4), with molecular formula C11H10O4 and molecular weight 206.06 g/mol. IUPAC: 3,7-dimethoxychromen-2-one.
Chemical Property Profile of 2H-1-Benzopyran-2-one, 3,7-dimethoxy-
Property Insights of 2H-1-Benzopyran-2-one, 3,7-dimethoxy-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-1-Benzopyran-2-one, 3,7-dimethoxy-. With a topological polar surface area (TPSA) of 44.8 Ų, 2H-1-Benzopyran-2-one, 3,7-dimethoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 3,7-dimethoxy- 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 2H-1-Benzopyran-2-one, 3,7-dimethoxy-?
The CAS number of 2H-1-Benzopyran-2-one, 3,7-dimethoxy- is 29076-68-4.
What is the molecular formula of 2H-1-Benzopyran-2-one, 3,7-dimethoxy-?
The molecular formula of 2H-1-Benzopyran-2-one, 3,7-dimethoxy- is C11H10O4.
What is the molecular weight of 2H-1-Benzopyran-2-one, 3,7-dimethoxy-?
The molecular weight of 2H-1-Benzopyran-2-one, 3,7-dimethoxy- is 206.06 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 3,7-dimethoxy-?
You can request a quote for 2H-1-Benzopyran-2-one, 3,7-dimethoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-1-Benzopyran-2-one, 3,7-dimethoxy-?
Yes, KEHONG BIO provides custom synthesis services for 2H-1-Benzopyran-2-one, 3,7-dimethoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.