1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one
TL;DR: 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one (CAS 306290-40-4) is a chemical compound with molecular formula C10H10N4O and molecular weight 202.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-phenyltetrazol-2-yl)propan-2-one
Also Known As: 2-Acetonyl-5-phenyl-2H-tetrazole, 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one, 1-(5-phenyltetrazol-2-yl)propan-2-one, J3.503.157J, 1-(5-phenyl-1,2,3,4-tetraazol-2-yl)acetone
| Molecular Formula | C10H10N4O |
|---|---|
| Molecular Weight | 202.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.08546 |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 306290-40-4 |
|---|---|
| SMILES | CC(=O)CN1N=C(N=N1)C2=CC=CC=C2 |
| InChIKey | PTIBICUPUMCMCG-UHFFFAOYSA-N |
Product Overview
1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one (CAS 306290-40-4), with molecular formula C10H10N4O and molecular weight 202.09 g/mol. IUPAC: 1-(5-phenyltetrazol-2-yl)propan-2-one.
Chemical Property Profile of 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one
Property Insights of 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one. Following Lipinski's Rule of Five, 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one has 0 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 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one?
The CAS number of 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one is 306290-40-4.
What is the molecular formula of 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one?
The molecular formula of 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one is C10H10N4O.
What is the molecular weight of 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one?
The molecular weight of 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one is 202.09 g/mol.
Where can I buy 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one?
You can request a quote for 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-phenyl-2H-tetrazol-2-yl)propan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.