![2-[1-(Aziridin-1-yl)butyl]cyclohexanone structure](/static/products/2180/21805-72-1.webp)
2-[1-(Aziridin-1-yl)butyl]cyclohexanone
TL;DR: 2-[1-(Aziridin-1-yl)butyl]cyclohexanone (CAS 21805-72-1) is a chemical compound with molecular formula C12H21NO and molecular weight 195.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(aziridin-1-yl)butyl]cyclohexan-1-one
Also Known As: 2-[1-(aziridin-1-yl)butyl]cyclohexanone, 2-[1-(aziridin-1-yl)butyl]cyclohexan-1-one, 1,3-Oxathiolane-2-thione,4-methyl, Cyclohexanone,2-[1-(1-aziridinyl)butyl]-
| Molecular Formula | C12H21NO |
|---|---|
| Molecular Weight | 195.16 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 20.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.16231 |
| Heavy Atoms | 14 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 21805-72-1 |
|---|---|
| SMILES | CCCC(C1CCCCC1=O)N2CC2 |
| InChIKey | QGUYMNQIYFSOGT-UHFFFAOYSA-N |
Product Overview
2-[1-(Aziridin-1-yl)butyl]cyclohexanone (CAS 21805-72-1), with molecular formula C12H21NO and molecular weight 195.16 g/mol. IUPAC: 2-[1-(aziridin-1-yl)butyl]cyclohexan-1-one.
Chemical Property Profile of 2-[1-(Aziridin-1-yl)butyl]cyclohexanone
Property Insights of 2-[1-(Aziridin-1-yl)butyl]cyclohexanone
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-(Aziridin-1-yl)butyl]cyclohexanone. With a topological polar surface area (TPSA) of 20.1 Ų, 2-[1-(Aziridin-1-yl)butyl]cyclohexanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[1-(Aziridin-1-yl)butyl]cyclohexanone has 0 hydrogen bond donor(s) and 2 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-[1-(Aziridin-1-yl)butyl]cyclohexanone?
The CAS number of 2-[1-(Aziridin-1-yl)butyl]cyclohexanone is 21805-72-1.
What is the molecular formula of 2-[1-(Aziridin-1-yl)butyl]cyclohexanone?
The molecular formula of 2-[1-(Aziridin-1-yl)butyl]cyclohexanone is C12H21NO.
What is the molecular weight of 2-[1-(Aziridin-1-yl)butyl]cyclohexanone?
The molecular weight of 2-[1-(Aziridin-1-yl)butyl]cyclohexanone is 195.16 g/mol.
Where can I buy 2-[1-(Aziridin-1-yl)butyl]cyclohexanone?
You can request a quote for 2-[1-(Aziridin-1-yl)butyl]cyclohexanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(Aziridin-1-yl)butyl]cyclohexanone?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(Aziridin-1-yl)butyl]cyclohexanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.