1-Benzylaziridine
TL;DR: 1-Benzylaziridine (CAS 1074-42-6) is a chemical compound with molecular formula C9H11N and molecular weight 133.08914 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-benzylaziridine
Also Known As: 1-Benzylaziridine, N-Benzylaziridine, N-Benzylethylenimine, 1-Benzylethylenimine, N-Benzyl Aziridine
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H11N |
| Molecular Weight | 133.08914 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 3.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 133.08914 Da |
| Heavy Atoms | 10 |
| Complexity | 101.0 |
| SMILES | C1CN1CC2=CC=CC=C2 |
| InChIKey | CASDNPHWJOQUQX-UHFFFAOYSA-N |
Chemical Property Profile of 1-Benzylaziridine
Property Insights of 1-Benzylaziridine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzylaziridine. With a topological polar surface area (TPSA) of 3.0 Ų, 1-Benzylaziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzylaziridine 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
What is the CAS number of 1-Benzylaziridine?
The CAS number of 1-Benzylaziridine is 1074-42-6.
What is the molecular formula of 1-Benzylaziridine?
The molecular formula of 1-Benzylaziridine is C9H11N.
What is the molecular weight of 1-Benzylaziridine?
The molecular weight of 1-Benzylaziridine is 133.08914 g/mol.
Where can I buy 1-Benzylaziridine?
You can request a quote for 1-Benzylaziridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Benzylaziridine?
Yes, CoreyChem provides custom synthesis services for 1-Benzylaziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.