(1-phenyl-1H-1,2,3-triazol-4-yl)methanol
TL;DR: (1-phenyl-1H-1,2,3-triazol-4-yl)methanol (CAS 103755-64-2) is a chemical compound with molecular formula C9H9N3O and molecular weight 175.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-phenyltriazol-4-yl)methanol
Also Known As: (1-phenyl-1H-1,2,3-triazol-4-yl)methanol, (1-phenyltriazol-4-yl)methanol, phenyltriazolylmethanol, 2,4-Difluorobenzoic acid, TimTec1_002499
| Molecular Formula | C9H9N3O |
|---|---|
| Molecular Weight | 175.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 50.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.07455 |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 103755-64-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(N=N2)CO |
| InChIKey | UBFOXHGJGFQOFV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1-phenyl-1H-1,2,3-triazol-4-yl)methanol (CAS 103755-64-2), with molecular formula C9H9N3O and molecular weight 175.07 g/mol. IUPAC: (1-phenyltriazol-4-yl)methanol.
Chemical Property Profile of (1-phenyl-1H-1,2,3-triazol-4-yl)methanol
Property Insights of (1-phenyl-1H-1,2,3-triazol-4-yl)methanol
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-phenyl-1H-1,2,3-triazol-4-yl)methanol. With a topological polar surface area (TPSA) of 50.9 Ų, (1-phenyl-1H-1,2,3-triazol-4-yl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-phenyl-1H-1,2,3-triazol-4-yl)methanol 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-phenyl-1H-1,2,3-triazol-4-yl)methanol?
The CAS number of (1-phenyl-1H-1,2,3-triazol-4-yl)methanol is 103755-64-2.
What is the molecular formula of (1-phenyl-1H-1,2,3-triazol-4-yl)methanol?
The molecular formula of (1-phenyl-1H-1,2,3-triazol-4-yl)methanol is C9H9N3O.
What is the molecular weight of (1-phenyl-1H-1,2,3-triazol-4-yl)methanol?
The molecular weight of (1-phenyl-1H-1,2,3-triazol-4-yl)methanol is 175.07 g/mol.
Where can I buy (1-phenyl-1H-1,2,3-triazol-4-yl)methanol?
You can request a quote for (1-phenyl-1H-1,2,3-triazol-4-yl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-phenyl-1H-1,2,3-triazol-4-yl)methanol?
Yes, KEHONG BIO provides custom synthesis services for (1-phenyl-1H-1,2,3-triazol-4-yl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.