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5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine structure
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5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine

TL;DR: 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine (CAS 117039-70-0) is a chemical compound with molecular formula C3H6N6 and molecular weight 126.06539 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5,6,7,8-tetrahydrotetrazolo[1,5-b][1,2,4]triazine

Also Known As: 5,6,7,8-tetrahydrotetrazolo[1,5-b][1,2,4]triazine, J3.565.693F, Tetrazolo[1,5-b][1,2,4]triazine, 1,5,6,7-tetrahydro-, 5H,6H,7H,8H-[1,2,3,4]TETRAZOLO[1,5-B][1,2,4]TRIAZINE, 3,5,6,7-tetrahydrotetrazolo[1,5-b][1,2,4]triazine

CAS Number
117039-70-0
Molecular Formula
C3H6N6
Molecular Weight
126.06539 g/mol
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Technical Specifications

Molecular FormulaC3H6N6
Molecular Weight126.06539 g/mol
XLogP0.1
Topological Polar Surface Area (TPSA)67.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds0
Exact Mass126.06539 Da
Heavy Atoms9
Complexity104.0
SMILESC1CNN2C(=NN=N2)N1
InChIKeyRNMCQEMQGJHTQF-UHFFFAOYSA-N

Chemical Property Profile of 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine

XLogP
0.1
TPSA (Topological Polar Surface Area)
67.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
0
Heavy Atoms
9
Complexity
104.0
Exact Mass
126.06539
Monoisotopic Mass
126.06539
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 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine

The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine. The TPSA of 67.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine. Following Lipinski's Rule of Five, 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine?

The CAS number of 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine is 117039-70-0.

What is the molecular formula of 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine?

The molecular formula of 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine is C3H6N6.

What is the molecular weight of 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine?

The molecular weight of 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine is 126.06539 g/mol.

Where can I buy 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine?

You can request a quote for 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine?

Yes, CoreyChem provides custom synthesis services for 5,6,7,8-Tetrahydrotetrazolo[1,5-b][1,2,4]triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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