p,alpha-DIMETHYLBENZYL ALCOHOL
TL;DR: p,alpha-DIMETHYLBENZYL ALCOHOL (CAS 536-50-5) 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.
1-(4-methylphenyl)ethanol
Also Known As: 1-(4-Methylphenyl)ethanol, 1-(p-Tolyl)ethanol, Bilagen, Norbilan, Tomobil
| Molecular Formula | C9H12O |
|---|---|
| Molecular Weight | 136.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 136.08882 |
| Heavy Atoms | 10 |
| Complexity | 92.0 |
| Density | 0.980-0.990 |
| Solubility | insoluble in water; soluble in organic solvents, oils |
| Refractive Index | 1.520-1.524 |
Chemical Identifiers
| CAS Number | 536-50-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C)O |
| InChIKey | JESIHYIJKKUWIS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p,alpha-DIMETHYLBENZYL ALCOHOL (CAS 536-50-5), with molecular formula C9H12O and molecular weight 136.09 g/mol. IUPAC: 1-(4-methylphenyl)ethanol.
Chemical Property Profile of p,alpha-DIMETHYLBENZYL ALCOHOL
Property Insights of p,alpha-DIMETHYLBENZYL ALCOHOL
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p,alpha-DIMETHYLBENZYL ALCOHOL. With a topological polar surface area (TPSA) of 20.2 Ų, p,alpha-DIMETHYLBENZYL ALCOHOL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p,alpha-DIMETHYLBENZYL 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 p,alpha-DIMETHYLBENZYL ALCOHOL?
The CAS number of p,alpha-DIMETHYLBENZYL ALCOHOL is 536-50-5.
What is the molecular formula of p,alpha-DIMETHYLBENZYL ALCOHOL?
The molecular formula of p,alpha-DIMETHYLBENZYL ALCOHOL is C9H12O.
What is the molecular weight of p,alpha-DIMETHYLBENZYL ALCOHOL?
The molecular weight of p,alpha-DIMETHYLBENZYL ALCOHOL is 136.09 g/mol.
Where can I buy p,alpha-DIMETHYLBENZYL ALCOHOL?
You can request a quote for p,alpha-DIMETHYLBENZYL ALCOHOL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p,alpha-DIMETHYLBENZYL ALCOHOL?
Yes, KEHONG BIO provides custom synthesis services for p,alpha-DIMETHYLBENZYL ALCOHOL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.