1-Benzotriazolylcyclohexan-1-ol
TL;DR: 1-Benzotriazolylcyclohexan-1-ol (CAS 136991-11-2) is a chemical compound with molecular formula C12H15N3O and molecular weight 217.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(benzotriazol-1-yl)cyclohexan-1-ol
Also Known As: 1-benzotriazolylcyclohexan-1-ol, 1-benzotriazol-1-ylcyclohexan-1-ol, 1-(1H-Benzotriazol-1-yl)cyclohexanol, 1-(benzotriazol-1-yl)cyclohexan-1-ol, 1-(1H-1,2,3-benzotriazol-1-yl)cyclohexan-1-ol
| Molecular Formula | C12H15N3O |
|---|---|
| Molecular Weight | 217.12 g/mol |
| LogP | 2.0405 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.1215 |
| Heavy Atoms | 16 |
| Complexity | 499.6881 |
Chemical Identifiers
| CAS Number | 136991-11-2 |
|---|---|
| SMILES | C1CCC(CC1)(N2C3=CC=CC=C3N=N2)O |
Product Overview
1-Benzotriazolylcyclohexan-1-ol (CAS 136991-11-2), with molecular formula C12H15N3O and molecular weight 217.12 g/mol. IUPAC: 1-(benzotriazol-1-yl)cyclohexan-1-ol.
Chemical Property Profile of 1-Benzotriazolylcyclohexan-1-ol
Property Insights of 1-Benzotriazolylcyclohexan-1-ol
The XLogP value of 2.0405 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzotriazolylcyclohexan-1-ol. With a topological polar surface area (TPSA) of 50.94 Ų, 1-Benzotriazolylcyclohexan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzotriazolylcyclohexan-1-ol 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-Benzotriazolylcyclohexan-1-ol?
The CAS number of 1-Benzotriazolylcyclohexan-1-ol is 136991-11-2.
What is the molecular formula of 1-Benzotriazolylcyclohexan-1-ol?
The molecular formula of 1-Benzotriazolylcyclohexan-1-ol is C12H15N3O.
What is the molecular weight of 1-Benzotriazolylcyclohexan-1-ol?
The molecular weight of 1-Benzotriazolylcyclohexan-1-ol is 217.12 g/mol.
Where can I buy 1-Benzotriazolylcyclohexan-1-ol?
You can request a quote for 1-Benzotriazolylcyclohexan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzotriazolylcyclohexan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzotriazolylcyclohexan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.