4-Ethylbenzyl alcohol
TL;DR: 4-Ethylbenzyl alcohol (CAS 768-59-2) is a chemical compound with molecular formula C9H12O and molecular weight 136.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethylphenyl)methanol
Also Known As: (4-Ethylphenyl)methanol, 4-ETHYLBENZYL ALCOHOL, 4-Ethylbenzylalcohol, Benzenemethanol, 4-ethyl-, 4-Ethylbenzenemethanol
| Molecular Formula | C9H12O |
|---|---|
| Molecular Weight | 136.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 136.08882 |
| Heavy Atoms | 10 |
| Complexity | 82.0 |
Chemical Identifiers
| CAS Number | 768-59-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)CO |
| InChIKey | YSLBFFIVJGJBSA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Ethylbenzyl alcohol (CAS 768-59-2), with molecular formula C9H12O and molecular weight 136.09 g/mol. IUPAC: (4-ethylphenyl)methanol.
Chemical Property Profile of 4-Ethylbenzyl alcohol
Property Insights of 4-Ethylbenzyl alcohol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethylbenzyl alcohol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Ethylbenzyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethylbenzyl alcohol has 1 hydrogen bond donor(s) and 1 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 4-Ethylbenzyl alcohol?
The CAS number of 4-Ethylbenzyl alcohol is 768-59-2.
What is the molecular formula of 4-Ethylbenzyl alcohol?
The molecular formula of 4-Ethylbenzyl alcohol is C9H12O.
What is the molecular weight of 4-Ethylbenzyl alcohol?
The molecular weight of 4-Ethylbenzyl alcohol is 136.09 g/mol.
Where can I buy 4-Ethylbenzyl alcohol?
You can request a quote for 4-Ethylbenzyl alcohol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethylbenzyl alcohol?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethylbenzyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.