2-(4-Azulyl)ethanol
TL;DR: 2-(4-Azulyl)ethanol (CAS 13935-44-9) is a chemical compound with molecular formula C12H12O and molecular weight 172.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-azulen-4-ylethanol
Also Known As: 2-(4-Azulyl)ethanol, 4-Azuleneethanol, 2-azulen-4-ylethanol, 4-(beta-Hydroxy-ethyl)-azulen, 2-(Azulen-4-yl)ethan-1-ol
| Molecular Formula | C12H12O |
|---|---|
| Molecular Weight | 172.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.08882 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 13935-44-9 |
|---|---|
| SMILES | C1=CC=C(C2=CC=CC2=C1)CCO |
| InChIKey | NUNNFXWRAPYHDM-UHFFFAOYSA-N |
Product Overview
2-(4-Azulyl)ethanol (CAS 13935-44-9), with molecular formula C12H12O and molecular weight 172.09 g/mol. IUPAC: 2-azulen-4-ylethanol.
Chemical Property Profile of 2-(4-Azulyl)ethanol
Property Insights of 2-(4-Azulyl)ethanol
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Azulyl)ethanol. With a topological polar surface area (TPSA) of 20.2 Ų, 2-(4-Azulyl)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Azulyl)ethanol 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 2-(4-Azulyl)ethanol?
The CAS number of 2-(4-Azulyl)ethanol is 13935-44-9.
What is the molecular formula of 2-(4-Azulyl)ethanol?
The molecular formula of 2-(4-Azulyl)ethanol is C12H12O.
What is the molecular weight of 2-(4-Azulyl)ethanol?
The molecular weight of 2-(4-Azulyl)ethanol is 172.09 g/mol.
Where can I buy 2-(4-Azulyl)ethanol?
You can request a quote for 2-(4-Azulyl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Azulyl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Azulyl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.