1H-1,2,3-benzotriazol-5-ylmethanol
TL;DR: 1H-1,2,3-benzotriazol-5-ylmethanol (CAS 106433-45-8) is a chemical compound with molecular formula C7H7N3O and molecular weight 149.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2H-benzotriazol-5-ylmethanol
Also Known As: (1H-benzo[d][1,2,3]triazol-5-yl)methanol, 1H-Benzotriazole-6-methanol, 2H-benzotriazol-5-ylmethanol, 3-Phenylbutyraldehyde, 1H-1,2,3-benzotriazol-5-ylmethanol
| Molecular Formula | C7H7N3O |
|---|---|
| Molecular Weight | 149.06 g/mol |
| LogP | 0.4502 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 149.05891 |
| Heavy Atoms | 11 |
| Complexity | 368.47812 |
Chemical Identifiers
| CAS Number | 106433-45-8 |
|---|---|
| SMILES | C1=CC2=NNN=C2C=C1CO |
Product Overview
1H-1,2,3-benzotriazol-5-ylmethanol (CAS 106433-45-8), with molecular formula C7H7N3O and molecular weight 149.06 g/mol. IUPAC: 2H-benzotriazol-5-ylmethanol.
Chemical Property Profile of 1H-1,2,3-benzotriazol-5-ylmethanol
Property Insights of 1H-1,2,3-benzotriazol-5-ylmethanol
The XLogP value of 0.4502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-1,2,3-benzotriazol-5-ylmethanol. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-1,2,3-benzotriazol-5-ylmethanol. Following Lipinski's Rule of Five, 1H-1,2,3-benzotriazol-5-ylmethanol has 2 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 1H-1,2,3-benzotriazol-5-ylmethanol?
The CAS number of 1H-1,2,3-benzotriazol-5-ylmethanol is 106433-45-8.
What is the molecular formula of 1H-1,2,3-benzotriazol-5-ylmethanol?
The molecular formula of 1H-1,2,3-benzotriazol-5-ylmethanol is C7H7N3O.
What is the molecular weight of 1H-1,2,3-benzotriazol-5-ylmethanol?
The molecular weight of 1H-1,2,3-benzotriazol-5-ylmethanol is 149.06 g/mol.
Where can I buy 1H-1,2,3-benzotriazol-5-ylmethanol?
You can request a quote for 1H-1,2,3-benzotriazol-5-ylmethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-1,2,3-benzotriazol-5-ylmethanol?
Yes, KEHONG BIO provides custom synthesis services for 1H-1,2,3-benzotriazol-5-ylmethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.