1-(Benzotriazol-1-yl)ethanol
TL;DR: 1-(Benzotriazol-1-yl)ethanol (CAS 111184-74-8) is a chemical compound with molecular formula C8H9N3O and molecular weight 163.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzotriazol-1-yl)ethanol
Also Known As: 1-(benzotriazol-1-yl)ethanol, 1-(1-hydroxyethyl)benzotriazole, alpha-methyl-1h-benzotriazole-1-methanol, 1-(1H-1,2,3-benzotriazol-1-yl)ethanol, 1-(1H-1,2,3-benzotriazol-1-yl)ethan-1-ol
| Molecular Formula | C8H9N3O |
|---|---|
| Molecular Weight | 163.07 g/mol |
| LogP | 0.9421 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 163.07455 |
| Heavy Atoms | 12 |
| Complexity | 393.85724 |
Chemical Identifiers
| CAS Number | 111184-74-8 |
|---|---|
| SMILES | CC(N1C2=CC=CC=C2N=N1)O |
Product Overview
1-(Benzotriazol-1-yl)ethanol (CAS 111184-74-8), with molecular formula C8H9N3O and molecular weight 163.07 g/mol. IUPAC: 1-(benzotriazol-1-yl)ethanol.
Chemical Property Profile of 1-(Benzotriazol-1-yl)ethanol
Property Insights of 1-(Benzotriazol-1-yl)ethanol
The XLogP value of 0.9421 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Benzotriazol-1-yl)ethanol. With a topological polar surface area (TPSA) of 50.94 Ų, 1-(Benzotriazol-1-yl)ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Benzotriazol-1-yl)ethanol has 1 hydrogen bond donor(s) and 3 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 1-(Benzotriazol-1-yl)ethanol?
The CAS number of 1-(Benzotriazol-1-yl)ethanol is 111184-74-8.
What is the molecular formula of 1-(Benzotriazol-1-yl)ethanol?
The molecular formula of 1-(Benzotriazol-1-yl)ethanol is C8H9N3O.
What is the molecular weight of 1-(Benzotriazol-1-yl)ethanol?
The molecular weight of 1-(Benzotriazol-1-yl)ethanol is 163.07 g/mol.
Where can I buy 1-(Benzotriazol-1-yl)ethanol?
You can request a quote for 1-(Benzotriazol-1-yl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzotriazol-1-yl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzotriazol-1-yl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.