7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one
TL;DR: 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one (CAS 7471-79-6) is a chemical compound with molecular formula C12H12O5 and molecular weight 236.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(1,2-dihydroxyethoxy)-4-methylchromen-2-one
Also Known As: 7-(1,2-dihydroxyethoxy)-4-methylchromen-2-one, 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one
| Molecular Formula | C12H12O5 |
|---|---|
| Molecular Weight | 236.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.06847 |
| Heavy Atoms | 17 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 7471-79-6 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OC(CO)O |
| InChIKey | AGDPEXUBUXVEBO-UHFFFAOYSA-N |
Product Overview
7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one (CAS 7471-79-6), with molecular formula C12H12O5 and molecular weight 236.07 g/mol. IUPAC: 7-(1,2-dihydroxyethoxy)-4-methylchromen-2-one.
Chemical Property Profile of 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one
Property Insights of 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one. Following Lipinski's Rule of Five, 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one has 2 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 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one?
The CAS number of 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one is 7471-79-6.
What is the molecular formula of 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one?
The molecular formula of 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one is C12H12O5.
What is the molecular weight of 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one?
The molecular weight of 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one is 236.07 g/mol.
Where can I buy 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one?
You can request a quote for 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-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 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 7-(1,2-Dihydroxyethoxy)-4-methyl-2H-1-benzopyran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.