Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester
TL;DR: Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester (CAS 67860-02-0) is a chemical compound with molecular formula C9H10O5 and molecular weight 198.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-4-oxopyran-3-yl) 2-hydroxypropanoate
Also Known As: Maltol lactate, Maltyl lactate, 2-Methyl-4-oxo-4H-pyran-3-yl lactate, 2-methyl-4-oxo-4H-pyran-3-yllactate, 2-methyl-4-oxo-4h-pyran-3-yl 2-hydroxypropanoate
| Molecular Formula | C9H10O5 |
|---|---|
| Molecular Weight | 198.05 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.05283 |
| Heavy Atoms | 14 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 67860-02-0 |
|---|---|
| SMILES | CC1=C(C(=O)C=CO1)OC(=O)C(C)O |
| InChIKey | MDIWGYQROJRXEW-UHFFFAOYSA-N |
Product Overview
Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester (CAS 67860-02-0), with molecular formula C9H10O5 and molecular weight 198.05 g/mol. IUPAC: (2-methyl-4-oxopyran-3-yl) 2-hydroxypropanoate.
Chemical Property Profile of Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester
Property Insights of Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester. Following Lipinski's Rule of Five, Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester has 1 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 Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester?
The CAS number of Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester is 67860-02-0.
What is the molecular formula of Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester?
The molecular formula of Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester is C9H10O5.
What is the molecular weight of Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester?
The molecular weight of Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester is 198.05 g/mol.
Where can I buy Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester?
You can request a quote for Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 2-hydroxy-, 2-methyl-4-oxo-4H-pyran-3-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.