Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate
TL;DR: Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate (CAS 634-20-8) is a chemical compound with molecular formula C13H14O6 and molecular weight 266.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(diacetyloxymethyl)phenyl] acetate
Also Known As: Methanediol, diacetate, Salicylaldehyde triacetate, (2-acetoxyphenyl)methylene diacetate, o-acetoxybenzylidene diacetate, [2-(diacetyloxymethyl)phenyl] acetate
| Molecular Formula | C13H14O6 |
|---|---|
| Molecular Weight | 266.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 266.07904 |
| Heavy Atoms | 19 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 634-20-8 |
|---|---|
| SMILES | CC(=O)OC1=CC=CC=C1C(OC(=O)C)OC(=O)C |
| InChIKey | DURAGTHQRQBUTE-UHFFFAOYSA-N |
Product Overview
Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate (CAS 634-20-8), with molecular formula C13H14O6 and molecular weight 266.08 g/mol. IUPAC: [2-(diacetyloxymethyl)phenyl] acetate.
Chemical Property Profile of Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate
Property Insights of Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate. Following Lipinski's Rule of Five, Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate 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 Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate?
The CAS number of Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate is 634-20-8.
What is the molecular formula of Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate?
The molecular formula of Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate is C13H14O6.
What is the molecular weight of Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate?
The molecular weight of Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate is 266.08 g/mol.
Where can I buy Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate?
You can request a quote for Methanediol, 1-[2-(acetyloxy)phenyl]-, 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-(acetyloxy)phenyl]-, 1,1-diacetate?
Yes, KEHONG BIO provides custom synthesis services for Methanediol, 1-[2-(acetyloxy)phenyl]-, 1,1-diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.