Benzyl alcohol, 3,5-diacetoxy-
TL;DR: Benzyl alcohol, 3,5-diacetoxy- (CAS 35354-30-4) is a chemical compound with molecular formula C11H12O5 and molecular weight 224.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-acetyloxy-5-(hydroxymethyl)phenyl] acetate
Also Known As: 3,5-DIACETOXYBENZYL ALCOHOL, Benzyl alcohol, 3,5-diacetoxy-, [3-acetyloxy-5-(hydroxymethyl)phenyl] acetate, 3-(Acetyloxy)-5-(hydroxymethyl)phenyl acetate, 3-(Acetyloxy)-5-(hydroxymethyl)phenyl acetate #
| Molecular Formula | C11H12O5 |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 224.06847 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 35354-30-4 |
|---|---|
| SMILES | CC(=O)OC1=CC(=CC(=C1)CO)OC(=O)C |
| InChIKey | PUAUSAWAPPDYMM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzyl alcohol, 3,5-diacetoxy- (CAS 35354-30-4), with molecular formula C11H12O5 and molecular weight 224.07 g/mol. IUPAC: [3-acetyloxy-5-(hydroxymethyl)phenyl] acetate.
Chemical Property Profile of Benzyl alcohol, 3,5-diacetoxy-
Property Insights of Benzyl alcohol, 3,5-diacetoxy-
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyl alcohol, 3,5-diacetoxy-. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl alcohol, 3,5-diacetoxy-. Following Lipinski's Rule of Five, Benzyl alcohol, 3,5-diacetoxy- 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 Benzyl alcohol, 3,5-diacetoxy-?
The CAS number of Benzyl alcohol, 3,5-diacetoxy- is 35354-30-4.
What is the molecular formula of Benzyl alcohol, 3,5-diacetoxy-?
The molecular formula of Benzyl alcohol, 3,5-diacetoxy- is C11H12O5.
What is the molecular weight of Benzyl alcohol, 3,5-diacetoxy-?
The molecular weight of Benzyl alcohol, 3,5-diacetoxy- is 224.07 g/mol.
Where can I buy Benzyl alcohol, 3,5-diacetoxy-?
You can request a quote for Benzyl alcohol, 3,5-diacetoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl alcohol, 3,5-diacetoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzyl alcohol, 3,5-diacetoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.