1-(But-2-en-1-yl)azetidine
TL;DR: 1-(But-2-en-1-yl)azetidine (CAS 69416-65-5) is a chemical compound with molecular formula C7H13N and molecular weight 111.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-but-2-enylazetidine
Also Known As: 1-(but-2-en-1-yl)azetidine, 1-But-2-enylazetidine, 1-(2-Buten-1-yl)azetidine
| Molecular Formula | C7H13N |
|---|---|
| Molecular Weight | 111.10 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 111.1048 |
| Heavy Atoms | 8 |
| Complexity | 82.0 |
Chemical Identifiers
| CAS Number | 69416-65-5 |
|---|---|
| SMILES | CC=CCN1CCC1 |
| InChIKey | WEFPHRCLYYRWCO-UHFFFAOYSA-N |
Product Overview
1-(But-2-en-1-yl)azetidine (CAS 69416-65-5), with molecular formula C7H13N and molecular weight 111.10 g/mol. IUPAC: 1-but-2-enylazetidine.
Chemical Property Profile of 1-(But-2-en-1-yl)azetidine
Property Insights of 1-(But-2-en-1-yl)azetidine
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(But-2-en-1-yl)azetidine. With a topological polar surface area (TPSA) of 3.2 Ų, 1-(But-2-en-1-yl)azetidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(But-2-en-1-yl)azetidine 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 1-(But-2-en-1-yl)azetidine?
The CAS number of 1-(But-2-en-1-yl)azetidine is 69416-65-5.
What is the molecular formula of 1-(But-2-en-1-yl)azetidine?
The molecular formula of 1-(But-2-en-1-yl)azetidine is C7H13N.
What is the molecular weight of 1-(But-2-en-1-yl)azetidine?
The molecular weight of 1-(But-2-en-1-yl)azetidine is 111.10 g/mol.
Where can I buy 1-(But-2-en-1-yl)azetidine?
You can request a quote for 1-(But-2-en-1-yl)azetidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(But-2-en-1-yl)azetidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(But-2-en-1-yl)azetidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.