2-Benzylaziridine
TL;DR: 2-Benzylaziridine (CAS 13906-90-6) 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.
2-benzylaziridine
Also Known As: 2-Benzylaziridine, (s)-2-benzylaziridine, 2-benzylaziridin, 2-benzyl-aziridine, Aziridine, 2-(phenylmethyl)-
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H11N |
| Molecular Weight | 133.08914 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 21.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 133.08914 Da |
| Heavy Atoms | 10 |
| Complexity | 105.0 |
| SMILES | C1C(N1)CC2=CC=CC=C2 |
| InChIKey | LKQAJXTWYDNYHK-UHFFFAOYSA-N |
Chemical Property Profile of 2-Benzylaziridine
Property Insights of 2-Benzylaziridine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzylaziridine. With a topological polar surface area (TPSA) of 21.9 Ų, 2-Benzylaziridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzylaziridine has 1 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 2-Benzylaziridine?
The CAS number of 2-Benzylaziridine is 13906-90-6.
What is the molecular formula of 2-Benzylaziridine?
The molecular formula of 2-Benzylaziridine is C9H11N.
What is the molecular weight of 2-Benzylaziridine?
The molecular weight of 2-Benzylaziridine is 133.08914 g/mol.
Where can I buy 2-Benzylaziridine?
You can request a quote for 2-Benzylaziridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Benzylaziridine?
Yes, CoreyChem provides custom synthesis services for 2-Benzylaziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.