2-(Aziridin-1-yl)but-3-en-1-yl butanoate
TL;DR: 2-(Aziridin-1-yl)but-3-en-1-yl butanoate (CAS 5110-75-8) is a chemical compound with molecular formula C10H17NO2 and molecular weight 183.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(aziridin-1-yl)but-3-enyl butanoate
Also Known As: 2-(aziridin-1-yl)but-3-enyl butanoate, 2-(Aziridin-1-yl)but-3-en-1-yl butanoate
| Molecular Formula | C10H17NO2 |
|---|---|
| Molecular Weight | 183.13 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 183.12593 |
| Heavy Atoms | 13 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 5110-75-8 |
|---|---|
| SMILES | CCCC(=O)OCC(C=C)N1CC1 |
| InChIKey | DDNAQQIRROCQQT-UHFFFAOYSA-N |
Product Overview
2-(Aziridin-1-yl)but-3-en-1-yl butanoate (CAS 5110-75-8), with molecular formula C10H17NO2 and molecular weight 183.13 g/mol. IUPAC: 2-(aziridin-1-yl)but-3-enyl butanoate.
Chemical Property Profile of 2-(Aziridin-1-yl)but-3-en-1-yl butanoate
Property Insights of 2-(Aziridin-1-yl)but-3-en-1-yl butanoate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Aziridin-1-yl)but-3-en-1-yl butanoate. With a topological polar surface area (TPSA) of 29.3 Ų, 2-(Aziridin-1-yl)but-3-en-1-yl butanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Aziridin-1-yl)but-3-en-1-yl butanoate has 0 hydrogen bond donor(s) and 3 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 2-(Aziridin-1-yl)but-3-en-1-yl butanoate?
The CAS number of 2-(Aziridin-1-yl)but-3-en-1-yl butanoate is 5110-75-8.
What is the molecular formula of 2-(Aziridin-1-yl)but-3-en-1-yl butanoate?
The molecular formula of 2-(Aziridin-1-yl)but-3-en-1-yl butanoate is C10H17NO2.
What is the molecular weight of 2-(Aziridin-1-yl)but-3-en-1-yl butanoate?
The molecular weight of 2-(Aziridin-1-yl)but-3-en-1-yl butanoate is 183.13 g/mol.
Where can I buy 2-(Aziridin-1-yl)but-3-en-1-yl butanoate?
You can request a quote for 2-(Aziridin-1-yl)but-3-en-1-yl butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Aziridin-1-yl)but-3-en-1-yl butanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Aziridin-1-yl)but-3-en-1-yl butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.