5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole
TL;DR: 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole (CAS 69746-30-1) is a chemical compound with molecular formula C8H7ClN4 and molecular weight 194.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-1-methyltetrazole
Also Known As: 5-(4-chlorophenyl)-1-methyltetrazole, 1-methyl-5-(4-chlorophenyl)tetrazole, 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole, 11J-313S, 5-(4-chlorophenyl)-1-methyl-1H-1,2,3,4-tetraazole
| Molecular Formula | C8H7ClN4 |
|---|---|
| Molecular Weight | 194.04 g/mol |
| LogP | 1.5305 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 194.03592 |
| Heavy Atoms | 13 |
| Complexity | 406.3373 |
Chemical Identifiers
| CAS Number | 69746-30-1 |
|---|---|
| SMILES | CN1C(=NN=N1)C2=CC=C(C=C2)Cl |
Product Overview
5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole (CAS 69746-30-1), with molecular formula C8H7ClN4 and molecular weight 194.04 g/mol. IUPAC: 5-(4-chlorophenyl)-1-methyltetrazole.
Chemical Property Profile of 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole
Property Insights of 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole
The XLogP value of 1.5305 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole. With a topological polar surface area (TPSA) of 43.6 Ų, 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole has 0 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 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole?
The CAS number of 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole is 69746-30-1.
What is the molecular formula of 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole?
The molecular formula of 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole is C8H7ClN4.
What is the molecular weight of 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole?
The molecular weight of 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole is 194.04 g/mol.
Where can I buy 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole?
You can request a quote for 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Chlorophenyl)-1-methyl-1H-1,2,3,4-tetrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.