二-O-乙酰曲酸
TL;DR: 二-O-乙酰曲酸 (CAS 26209-93-8) is a chemical compound with molecular formula C10H10O6 and molecular weight 226.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二-O-乙酰曲酸
(5-acetyloxy-4-oxopyran-2-yl)methyl acetate
Also Known As: Di-O-acetylkojic acid, 5-Acetoxy-2-acetoxymethylpyr-4-one, 5-Acetoxy-2-acetoxymethylpyron-4, NCIOpen2_004113, FTWYBBBWGWWCAZ-UHFFFAOYSA-
| Molecular Formula | C10H10O6 |
|---|---|
| Molecular Weight | 226.05 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.04774 |
| Heavy Atoms | 16 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 26209-93-8 |
|---|---|
| SMILES | CC(=O)OCC1=CC(=O)C(=CO1)OC(=O)C |
| InChIKey | FTWYBBBWGWWCAZ-UHFFFAOYSA-N |
Product Overview
二-O-乙酰曲酸 (CAS 26209-93-8), with molecular formula C10H10O6 and molecular weight 226.05 g/mol. IUPAC: (5-acetyloxy-4-oxopyran-2-yl)methyl acetate.
Chemical Property Profile of 二-O-乙酰曲酸
Property Insights of 二-O-乙酰曲酸
The XLogP value of -0.2 indicates that 二-O-乙酰曲酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 二-O-乙酰曲酸. Following Lipinski's Rule of Five, 二-O-乙酰曲酸 has 0 hydrogen bond donor(s) and 6 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 二-O-乙酰曲酸?
The CAS number of 二-O-乙酰曲酸 is 26209-93-8.
What is the molecular formula of 二-O-乙酰曲酸?
The molecular formula of 二-O-乙酰曲酸 is C10H10O6.
What is the molecular weight of 二-O-乙酰曲酸?
The molecular weight of 二-O-乙酰曲酸 is 226.05 g/mol.
Where can I buy 二-O-乙酰曲酸?
You can request a quote for 二-O-乙酰曲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二-O-乙酰曲酸?
Yes, KEHONG BIO provides custom synthesis services for 二-O-乙酰曲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.