2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid
TL;DR: 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid (CAS 1212350-00-9) is a chemical compound with molecular formula C9H8N4O2 and molecular weight 204.06473 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenyl-2-(tetrazol-1-yl)acetic acid
Also Known As: phenyl(1H-tetrazol-1-yl)acetic acid, Phenyl-tetrazol-1-yl-acetic acid, PHENYL ACETICACID, 2-phenyl-2-(1H-tetrazol-1-yl)acetic acid, 2-phenyl-2-(tetrazol-1-yl)acetic acid
Technical Specifications
| Molecular Formula | C9H8N4O2 |
| Molecular Weight | 204.06473 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.06473 Da |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
| SMILES | C1=CC=C(C=C1)C(C(=O)O)N2C=NN=N2 |
| InChIKey | SMVWFPKUWFVUKN-UHFFFAOYSA-N |
Chemical Property Profile of 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid
Property Insights of 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid. Following Lipinski's Rule of Five, 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid has 1 hydrogen bond donor(s) and 5 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-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid?
The CAS number of 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid is 1212350-00-9.
What is the molecular formula of 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid?
The molecular formula of 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid is C9H8N4O2.
What is the molecular weight of 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid?
The molecular weight of 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid is 204.06473 g/mol.
Where can I buy 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid?
You can request a quote for 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid?
Yes, CoreyChem provides custom synthesis services for 2-phenyl-2-(1H-1,2,3,4-tetrazol-1-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.