![3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol structure](/static/products/5332/5332-88-7.webp)
3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol
TL;DR: 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol (CAS 5332-88-7) is a chemical compound with molecular formula C9H8N4O and molecular weight 188.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(E)-1,2,4-triazol-4-yliminomethyl]phenol
Also Known As: 3-[(4h-1,2,4-triazol-4-ylimino)methyl]phenol, 3-[(E)-(4H-1,2,4-triazol-4-ylimino)methyl]phenol, 3-[(E)-1,2,4-triazol-4-yliminomethyl]phenol, (E)-3-(((4H-1,2,4-triazol-4-yl)imino)methyl)phenol, 3-((1E)-2-(1,2,4-triazol-4-yl)-2-azavinyl)phenol
| Molecular Formula | C9H8N4O |
|---|---|
| Molecular Weight | 188.07 g/mol |
| LogP | 0.8659 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.06981 |
| Heavy Atoms | 14 |
| Complexity | 435.83243 |
Chemical Identifiers
| CAS Number | 5332-88-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)O)/C=N/N2C=NN=C2 |
Product Overview
3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol (CAS 5332-88-7), with molecular formula C9H8N4O and molecular weight 188.07 g/mol. IUPAC: 3-[(E)-1,2,4-triazol-4-yliminomethyl]phenol.
Chemical Property Profile of 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol
Property Insights of 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol
The XLogP value of 0.8659 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol. Following Lipinski's Rule of Five, 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol has 1 hydrogen bond donor(s) and 4 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 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol?
The CAS number of 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol is 5332-88-7.
What is the molecular formula of 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol?
The molecular formula of 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol is C9H8N4O.
What is the molecular weight of 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol?
The molecular weight of 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol is 188.07 g/mol.
Where can I buy 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol?
You can request a quote for 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4h-1,2,4-Triazol-4-ylimino)methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.