3-Phenoxybenzyl alcohol
TL;DR: 3-Phenoxybenzyl alcohol (CAS 13826-35-2) is a chemical compound with molecular formula C13H12O2 and molecular weight 200.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-phenoxyphenyl)methanol
Also Known As: 3-Phenoxybenzyl alcohol, (3-Phenoxyphenyl)methanol, 3-Phenoxybenzenemethanol, m-Phenoxybenzyl alcohol, 3-Phenoxybenzylalcohol
| Molecular Formula | C13H12O2 |
|---|---|
| Molecular Weight | 200.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 200.08372 |
| Heavy Atoms | 15 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 13826-35-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)CO |
| InChIKey | KGANAERDZBAECK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Phenoxybenzyl alcohol (CAS 13826-35-2), with molecular formula C13H12O2 and molecular weight 200.08 g/mol. IUPAC: (3-phenoxyphenyl)methanol.
Chemical Property Profile of 3-Phenoxybenzyl alcohol
Property Insights of 3-Phenoxybenzyl alcohol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenoxybenzyl alcohol. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Phenoxybenzyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenoxybenzyl alcohol has 1 hydrogen bond donor(s) and 2 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 3-Phenoxybenzyl alcohol?
The CAS number of 3-Phenoxybenzyl alcohol is 13826-35-2.
What is the molecular formula of 3-Phenoxybenzyl alcohol?
The molecular formula of 3-Phenoxybenzyl alcohol is C13H12O2.
What is the molecular weight of 3-Phenoxybenzyl alcohol?
The molecular weight of 3-Phenoxybenzyl alcohol is 200.08 g/mol.
Where can I buy 3-Phenoxybenzyl alcohol?
You can request a quote for 3-Phenoxybenzyl alcohol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenoxybenzyl alcohol?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenoxybenzyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.