Benzenemethanol, alpha-methoxy-, acetate
TL;DR: Benzenemethanol, alpha-methoxy-, acetate (CAS 51835-45-1) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[methoxy(phenyl)methyl] acetate
Also Known As: Methoxybenzyl acetate, Methoxy(phenyl)methyl acetate, [methoxy(phenyl)methyl] acetate, alpha-Methoxybenzenemethanol acetate, Methoxy(phenyl)methyl acetate #
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 51835-45-1 |
|---|---|
| SMILES | CC(=O)OC(C1=CC=CC=C1)OC |
| InChIKey | RWHCVQYHXAVMQT-UHFFFAOYSA-N |
Product Overview
Benzenemethanol, alpha-methoxy-, acetate (CAS 51835-45-1), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: [methoxy(phenyl)methyl] acetate.
Chemical Property Profile of Benzenemethanol, alpha-methoxy-, acetate
Property Insights of Benzenemethanol, alpha-methoxy-, acetate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanol, alpha-methoxy-, acetate. With a topological polar surface area (TPSA) of 35.5 Ų, Benzenemethanol, alpha-methoxy-, acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanol, alpha-methoxy-, acetate has 0 hydrogen bond donor(s) and 3 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 Benzenemethanol, alpha-methoxy-, acetate?
The CAS number of Benzenemethanol, alpha-methoxy-, acetate is 51835-45-1.
What is the molecular formula of Benzenemethanol, alpha-methoxy-, acetate?
The molecular formula of Benzenemethanol, alpha-methoxy-, acetate is C10H12O3.
What is the molecular weight of Benzenemethanol, alpha-methoxy-, acetate?
The molecular weight of Benzenemethanol, alpha-methoxy-, acetate is 180.08 g/mol.
Where can I buy Benzenemethanol, alpha-methoxy-, acetate?
You can request a quote for Benzenemethanol, alpha-methoxy-, acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanol, alpha-methoxy-, acetate?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanol, alpha-methoxy-, acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.