3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid
TL;DR: 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid (CAS 27604-46-2) is a chemical compound with molecular formula C11H12N4O2 and molecular weight 232.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(4-methylphenyl)tetrazol-2-yl]propanoic acid
Also Known As: 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid, 3-[5-(4-methylphenyl)tetrazol-2-yl]propanoic Acid, 2H-Tetrazole-2-propanoic acid, 5-(4-methylphenyl)-
| Molecular Formula | C11H12N4O2 |
|---|---|
| Molecular Weight | 232.10 g/mol |
| LogP | 1.12322 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.09602 |
| Heavy Atoms | 17 |
| Complexity | 518.52264 |
Chemical Identifiers
| CAS Number | 27604-46-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NN(N=N2)CCC(=O)O |
Product Overview
3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid (CAS 27604-46-2), with molecular formula C11H12N4O2 and molecular weight 232.10 g/mol. IUPAC: 3-[5-(4-methylphenyl)tetrazol-2-yl]propanoic acid.
Chemical Property Profile of 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid
Property Insights of 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid
The XLogP value of 1.12322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid. Following Lipinski's Rule of Five, 3-(5-p-Tolyl-tetrazol-2-yl)-propionic 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 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid?
The CAS number of 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid is 27604-46-2.
What is the molecular formula of 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid?
The molecular formula of 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid is C11H12N4O2.
What is the molecular weight of 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid?
The molecular weight of 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid is 232.10 g/mol.
Where can I buy 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid?
You can request a quote for 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-p-Tolyl-tetrazol-2-yl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.