5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid
TL;DR: 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid (CAS 81595-01-9) is a chemical compound with molecular formula C10H10N4O2 and molecular weight 218.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(3-methylphenyl)tetrazol-2-yl]acetic acid
Also Known As: 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid, BAS 04360438, [5-(3-methylphenyl)-2H-tetrazol-2-yl]acetic acid, (5-m-Tolyl-tetrazol-2-yl)-acetic acid, 2-(5-(M-tolyl)-2H-tetrazol-2-yl)acetic acid
| Molecular Formula | C10H10N4O2 |
|---|---|
| Molecular Weight | 218.08 g/mol |
| LogP | 0.73312 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.08037 |
| Heavy Atoms | 16 |
| Complexity | 521.0425 |
Chemical Identifiers
| CAS Number | 81595-01-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NN(N=N2)CC(=O)O |
Product Overview
5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid (CAS 81595-01-9), with molecular formula C10H10N4O2 and molecular weight 218.08 g/mol. IUPAC: 2-[5-(3-methylphenyl)tetrazol-2-yl]acetic acid.
Chemical Property Profile of 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid
Property Insights of 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid
The XLogP value of 0.73312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid. Following Lipinski's Rule of Five, 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid 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
Frequently Asked Questions
What is the CAS number of 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid?
The CAS number of 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid is 81595-01-9.
What is the molecular formula of 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid?
The molecular formula of 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid is C10H10N4O2.
What is the molecular weight of 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid?
The molecular weight of 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid is 218.08 g/mol.
Where can I buy 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid?
You can request a quote for 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(3-Methylphenyl)-2H-tetrazole-2-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.