alpha-Methyl-1,4-benzenedimethanol
TL;DR: alpha-Methyl-1,4-benzenedimethanol (CAS 80463-22-5) is a chemical compound with molecular formula C9H12O2 and molecular weight 152.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(hydroxymethyl)phenyl]ethanol
Also Known As: 1-(4-(Hydroxymethyl)phenyl)ethan-1-ol, 1-[4-(Hydroxymethyl)phenyl]ethanol, 4-(1-Hydroxyethyl)benzenemethanol, 4-(1-Hydroxyethyl)benzyl alcohol, alpha-Methyl-1,4-benzenedimethanol
| Molecular Formula | C9H12O2 |
|---|---|
| Molecular Weight | 152.08 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.08372 |
| Heavy Atoms | 11 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 80463-22-5 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)CO)O |
| InChIKey | OZHROFCXIMHHRO-UHFFFAOYSA-N |
Product Overview
alpha-Methyl-1,4-benzenedimethanol (CAS 80463-22-5), with molecular formula C9H12O2 and molecular weight 152.08 g/mol. IUPAC: 1-[4-(hydroxymethyl)phenyl]ethanol.
Chemical Property Profile of alpha-Methyl-1,4-benzenedimethanol
Property Insights of alpha-Methyl-1,4-benzenedimethanol
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Methyl-1,4-benzenedimethanol. With a topological polar surface area (TPSA) of 40.5 Ų, alpha-Methyl-1,4-benzenedimethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Methyl-1,4-benzenedimethanol has 2 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 alpha-Methyl-1,4-benzenedimethanol?
The CAS number of alpha-Methyl-1,4-benzenedimethanol is 80463-22-5.
What is the molecular formula of alpha-Methyl-1,4-benzenedimethanol?
The molecular formula of alpha-Methyl-1,4-benzenedimethanol is C9H12O2.
What is the molecular weight of alpha-Methyl-1,4-benzenedimethanol?
The molecular weight of alpha-Methyl-1,4-benzenedimethanol is 152.08 g/mol.
Where can I buy alpha-Methyl-1,4-benzenedimethanol?
You can request a quote for alpha-Methyl-1,4-benzenedimethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Methyl-1,4-benzenedimethanol?
Yes, KEHONG BIO provides custom synthesis services for alpha-Methyl-1,4-benzenedimethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.