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2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol structure
Fine Chemical

2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol

TL;DR: 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol (CAS 166766-15-0) is a chemical compound with molecular formula C12H7N5O2 and molecular weight 253.05997 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(triazolo[4,5-g][2,1,3]benzoxadiazol-7-yl)phenol

Also Known As: NCI60_024220, 2-(triazolo[4,5-g][2,1,3]benzoxadiazol-7-yl)phenol, 7-(2-Hydroxyphenyl)(7H)triazolo[e]benzofurazan, 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol, Phenol, 2-(7H-furazano[3,4-E]benzotriazol-7-yl)-

CAS Number
166766-15-0
Molecular Formula
C12H7N5O2
Molecular Weight
253.05997 g/mol
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Technical Specifications

Molecular FormulaC12H7N5O2
Molecular Weight253.05997 g/mol
XLogP2.2
Topological Polar Surface Area (TPSA)89.9 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors6
Rotatable Bonds1
Exact Mass253.05997 Da
Heavy Atoms19
Complexity344.0
SMILESC1=CC=C(C(=C1)N2N=C3C=CC4=NON=C4C3=N2)O
InChIKeyKIACNIKPMWVBNY-UHFFFAOYSA-N

Chemical Property Profile of 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol

XLogP
2.2
TPSA (Topological Polar Surface Area)
89.9
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
6
Rotatable Bonds
1
Heavy Atoms
19
Complexity
344.0
Exact Mass
253.05997
Monoisotopic Mass
253.05997
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol

The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol. Following Lipinski's Rule of Five, 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol?

The CAS number of 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol is 166766-15-0.

What is the molecular formula of 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol?

The molecular formula of 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol is C12H7N5O2.

What is the molecular weight of 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol?

The molecular weight of 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol is 253.05997 g/mol.

Where can I buy 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol?

You can request a quote for 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol?

Yes, CoreyChem provides custom synthesis services for 2-(7H-[1,2,3]Triazolo[4,5-E][2,1,3]benzoxadiazol-7-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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