3-Ethenylbenzyl alcohol
TL;DR: 3-Ethenylbenzyl alcohol (CAS 45804-94-2) is a chemical compound with molecular formula C9H10O and molecular weight 134.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-ethenylphenyl)methanol
Also Known As: 3-Ethenylbenzyl alcohol, (3-ethenylphenyl)methanol, 3-vinylbenzyl alcohol, 3-Vinylbenzenemethanol, (3-Vinylphenyl)methanol
| Molecular Formula | C9H10O |
|---|---|
| Molecular Weight | 134.07 g/mol |
| LogP | 1.8219 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 134.07317 |
| Heavy Atoms | 10 |
| Complexity | 227.9248 |
Chemical Identifiers
| CAS Number | 45804-94-2 |
|---|---|
| SMILES | C=CC1=CC=CC(=C1)CO |
Product Overview
3-Ethenylbenzyl alcohol (CAS 45804-94-2), with molecular formula C9H10O and molecular weight 134.07 g/mol. IUPAC: (3-ethenylphenyl)methanol.
Chemical Property Profile of 3-Ethenylbenzyl alcohol
Property Insights of 3-Ethenylbenzyl alcohol
The XLogP value of 1.8219 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethenylbenzyl alcohol. With a topological polar surface area (TPSA) of 20.23 Ų, 3-Ethenylbenzyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethenylbenzyl 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 3-Ethenylbenzyl alcohol?
The CAS number of 3-Ethenylbenzyl alcohol is 45804-94-2.
What is the molecular formula of 3-Ethenylbenzyl alcohol?
The molecular formula of 3-Ethenylbenzyl alcohol is C9H10O.
What is the molecular weight of 3-Ethenylbenzyl alcohol?
The molecular weight of 3-Ethenylbenzyl alcohol is 134.07 g/mol.
Where can I buy 3-Ethenylbenzyl alcohol?
You can request a quote for 3-Ethenylbenzyl alcohol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethenylbenzyl alcohol?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethenylbenzyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.