N-Benzoylaziridine
TL;DR: N-Benzoylaziridine (CAS 7646-66-4) is a chemical compound with molecular formula C9H9NO and molecular weight 147.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
aziridin-1-yl(phenyl)methanone
Also Known As: 1-Benzoylaziridine, N-Benzoylaziridine, 1-Benzoylethylenimine, N-Benzoylethylenimine, Benzoylethylenimide
| Molecular Formula | C9H9NO |
|---|---|
| Molecular Weight | 147.07 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 20.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.06842 |
| Heavy Atoms | 11 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 7646-66-4 |
|---|---|
| SMILES | C1CN1C(=O)C2=CC=CC=C2 |
| InChIKey | HGBCPYMIZWPKMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Benzoylaziridine (CAS 7646-66-4), with molecular formula C9H9NO and molecular weight 147.07 g/mol. IUPAC: aziridin-1-yl(phenyl)methanone.
Chemical Property Profile of N-Benzoylaziridine
Property Insights of N-Benzoylaziridine
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzoylaziridine. With a topological polar surface area (TPSA) of 20.1 Ų, N-Benzoylaziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzoylaziridine has 0 hydrogen bond donor(s) and 1 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 N-Benzoylaziridine?
The CAS number of N-Benzoylaziridine is 7646-66-4.
What is the molecular formula of N-Benzoylaziridine?
The molecular formula of N-Benzoylaziridine is C9H9NO.
What is the molecular weight of N-Benzoylaziridine?
The molecular weight of N-Benzoylaziridine is 147.07 g/mol.
Where can I buy N-Benzoylaziridine?
You can request a quote for N-Benzoylaziridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzoylaziridine?
Yes, KEHONG BIO provides custom synthesis services for N-Benzoylaziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.