2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1)
TL;DR: 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1) (CAS 93977-31-2) is a chemical compound with molecular formula C2HF3N4 and molecular weight 138.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(trifluoromethyl)-2H-tetrazole
Also Known As: 5-(trifluoromethyl)-2H-tetrazole, 5-Trifluoromethyltetrazole, 2H-Tetrazole, 5-(trifluoromethyl)-, 5-(trifluoromethyl)-1H-tetrazole, trifluoromethyltetrazole
| Molecular Formula | C2HF3N4 |
|---|---|
| Molecular Weight | 138.02 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 138.01534 |
| Heavy Atoms | 9 |
| Complexity | 100.0 |
Chemical Identifiers
| CAS Number | 93977-31-2 |
|---|---|
| SMILES | C1(=NNN=N1)C(F)(F)F |
| InChIKey | FOEPLOQMUWYHBM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1) (CAS 93977-31-2), with molecular formula C2HF3N4 and molecular weight 138.02 g/mol. IUPAC: 5-(trifluoromethyl)-2H-tetrazole.
Chemical Property Profile of 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1)
Property Insights of 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1)
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1). With a topological polar surface area (TPSA) of 54.5 Ų, 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1) 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
Frequently Asked Questions
What is the CAS number of 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1)?
The CAS number of 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1) is 93977-31-2.
What is the molecular formula of 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1)?
The molecular formula of 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1) is C2HF3N4.
What is the molecular weight of 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1)?
The molecular weight of 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1) is 138.02 g/mol.
Where can I buy 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1)?
You can request a quote for 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 2H-Tetrazole, 5-(trifluoromethyl)-, sodium salt (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.