4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one
TL;DR: 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one (CAS 6457-92-7) is a chemical compound with molecular formula C12H8O3 and molecular weight 200.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylfuro[2,3-h]chromen-2-one
Also Known As: 4-Methylangelicin, 4-methyl-angelicin, Methylangelicin, 4-, 4-Methyl-2H-furo[2,3-H]chromen-2-one, 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one
| Molecular Formula | C12H8O3 |
|---|---|
| Molecular Weight | 200.05 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.04735 |
| Heavy Atoms | 15 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 6457-92-7 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC3=C2C=CO3 |
| InChIKey | HCYYGOURSFQHRV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one (CAS 6457-92-7), with molecular formula C12H8O3 and molecular weight 200.05 g/mol. IUPAC: 4-methylfuro[2,3-h]chromen-2-one.
Chemical Property Profile of 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one
Property Insights of 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one. With a topological polar surface area (TPSA) of 39.4 Ų, 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one has 0 hydrogen bond donor(s) and 3 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-2H-furo(2,3-h)-1-benzopyran-2-one?
The CAS number of 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one is 6457-92-7.
What is the molecular formula of 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one?
The molecular formula of 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one is C12H8O3.
What is the molecular weight of 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one?
The molecular weight of 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one is 200.05 g/mol.
Where can I buy 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one?
You can request a quote for 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-2H-furo(2,3-h)-1-benzopyran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.