Methanediol, 1-(2-furanyl)-, 1,1-diacetate
TL;DR: Methanediol, 1-(2-furanyl)-, 1,1-diacetate (CAS 613-75-2) 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.
[acetyloxy(furan-2-yl)methyl] acetate
Also Known As: Furfurylidene diacetate, Furfural diacetate, methylacetate, (acetyloxy)(2-furyl)methyl acetate, 2-(Diacetoxymethyl)furan
| Molecular Formula | C9H10O5 |
|---|---|
| Molecular Weight | 198.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 65.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 198.05283 |
| Heavy Atoms | 14 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 613-75-2 |
|---|---|
| SMILES | CC(=O)OC(C1=CC=CO1)OC(=O)C |
| InChIKey | NHOCEIKFQXQFMX-UHFFFAOYSA-N |
Product Overview
Methanediol, 1-(2-furanyl)-, 1,1-diacetate (CAS 613-75-2), with molecular formula C9H10O5 and molecular weight 198.05 g/mol. IUPAC: [acetyloxy(furan-2-yl)methyl] acetate.
Chemical Property Profile of Methanediol, 1-(2-furanyl)-, 1,1-diacetate
Property Insights of Methanediol, 1-(2-furanyl)-, 1,1-diacetate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanediol, 1-(2-furanyl)-, 1,1-diacetate. The TPSA of 65.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Methanediol, 1-(2-furanyl)-, 1,1-diacetate. Following Lipinski's Rule of Five, Methanediol, 1-(2-furanyl)-, 1,1-diacetate has 0 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 Methanediol, 1-(2-furanyl)-, 1,1-diacetate?
The CAS number of Methanediol, 1-(2-furanyl)-, 1,1-diacetate is 613-75-2.
What is the molecular formula of Methanediol, 1-(2-furanyl)-, 1,1-diacetate?
The molecular formula of Methanediol, 1-(2-furanyl)-, 1,1-diacetate is C9H10O5.
What is the molecular weight of Methanediol, 1-(2-furanyl)-, 1,1-diacetate?
The molecular weight of Methanediol, 1-(2-furanyl)-, 1,1-diacetate is 198.05 g/mol.
Where can I buy Methanediol, 1-(2-furanyl)-, 1,1-diacetate?
You can request a quote for Methanediol, 1-(2-furanyl)-, 1,1-diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanediol, 1-(2-furanyl)-, 1,1-diacetate?
Yes, KEHONG BIO provides custom synthesis services for Methanediol, 1-(2-furanyl)-, 1,1-diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.