2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline
TL;DR: 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline (CAS 384860-18-8) is a chemical compound with molecular formula C8H9N5 and molecular weight 175.0858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-5-(tetrazol-1-yl)aniline
Also Known As: 2-methyl-5-(1H-tetrazol-1-yl)aniline, 2-methyl-5-(tetrazol-1-yl)aniline, 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline, 2-Methyl-5-tetrazol-1-yl-phenylamine, 2-methyl-5-tetrazol-1-ylphenylamine
Technical Specifications
| Molecular Formula | C8H9N5 |
| Molecular Weight | 175.0858 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.0858 Da |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
| SMILES | CC1=C(C=C(C=C1)N2C=NN=N2)N |
| InChIKey | NEYJGZGFZZOFEQ-UHFFFAOYSA-N |
Chemical Property Profile of 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline
Property Insights of 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline. Following Lipinski's Rule of Five, 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline 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
What is the CAS number of 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline?
The CAS number of 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline is 384860-18-8.
What is the molecular formula of 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline?
The molecular formula of 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline is C8H9N5.
What is the molecular weight of 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline?
The molecular weight of 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline is 175.0858 g/mol.
Where can I buy 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline?
You can request a quote for 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline?
Yes, CoreyChem provides custom synthesis services for 2-methyl-5-(1H-1,2,3,4-tetrazol-1-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.