1-(Azepan-1-yl)-2-ethoxyethanone
TL;DR: 1-(Azepan-1-yl)-2-ethoxyethanone (CAS 600139-89-7) is a chemical compound with molecular formula C10H19NO2 and molecular weight 185.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)-2-ethoxyethanone
Also Known As: 1-(azepan-1-yl)-2-ethoxyethanone, 1H-Azepine,1- hexahydro-, 1H-azepine,1-(ethoxyacetyl)hexahydro-, 1-(azepan-1-yl)-2-ethoxyethan-1-one, 1-(azepan-1-yl)-2-ethoxy-ethanone
| Molecular Formula | C10H19NO2 |
|---|---|
| Molecular Weight | 185.14 g/mol |
| LogP | 1.4255 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.14159 |
| Heavy Atoms | 13 |
| Complexity | 151.00374 |
Chemical Identifiers
| CAS Number | 600139-89-7 |
|---|---|
| SMILES | CCOCC(=O)N1CCCCCC1 |
Product Overview
1-(Azepan-1-yl)-2-ethoxyethanone (CAS 600139-89-7), with molecular formula C10H19NO2 and molecular weight 185.14 g/mol. IUPAC: 1-(azepan-1-yl)-2-ethoxyethanone.
Chemical Property Profile of 1-(Azepan-1-yl)-2-ethoxyethanone
Property Insights of 1-(Azepan-1-yl)-2-ethoxyethanone
The XLogP value of 1.4255 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Azepan-1-yl)-2-ethoxyethanone. With a topological polar surface area (TPSA) of 29.54 Ų, 1-(Azepan-1-yl)-2-ethoxyethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Azepan-1-yl)-2-ethoxyethanone 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 1-(Azepan-1-yl)-2-ethoxyethanone?
The CAS number of 1-(Azepan-1-yl)-2-ethoxyethanone is 600139-89-7.
What is the molecular formula of 1-(Azepan-1-yl)-2-ethoxyethanone?
The molecular formula of 1-(Azepan-1-yl)-2-ethoxyethanone is C10H19NO2.
What is the molecular weight of 1-(Azepan-1-yl)-2-ethoxyethanone?
The molecular weight of 1-(Azepan-1-yl)-2-ethoxyethanone is 185.14 g/mol.
Where can I buy 1-(Azepan-1-yl)-2-ethoxyethanone?
You can request a quote for 1-(Azepan-1-yl)-2-ethoxyethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Azepan-1-yl)-2-ethoxyethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(Azepan-1-yl)-2-ethoxyethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.