1-(Azetidin-1-yl)-2-chloroethan-1-one
TL;DR: 1-(Azetidin-1-yl)-2-chloroethan-1-one (CAS 63177-41-3) is a chemical compound with molecular formula C5H8ClNO and molecular weight 133.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azetidin-1-yl)-2-chloroethanone
Also Known As: 1-Azetidin-1-yl-2-chloro-ethanone, 1-(azetidin-1-yl)-2-chloroethanone, 1-(chloroacetyl)azetidine, 1-(azetidin-1-yl)-2-chloroethan-1-one, Azetidine, 1-(chloroacetyl)- (9CI)
| Molecular Formula | C5H8ClNO |
|---|---|
| Molecular Weight | 133.03 g/mol |
| LogP | 0.4575 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 133.02943 |
| Heavy Atoms | 8 |
| Complexity | 100.60179 |
Chemical Identifiers
| CAS Number | 63177-41-3 |
|---|---|
| SMILES | C1CN(C1)C(=O)CCl |
Product Overview
1-(Azetidin-1-yl)-2-chloroethan-1-one (CAS 63177-41-3), with molecular formula C5H8ClNO and molecular weight 133.03 g/mol. IUPAC: 1-(azetidin-1-yl)-2-chloroethanone.
Chemical Property Profile of 1-(Azetidin-1-yl)-2-chloroethan-1-one
Property Insights of 1-(Azetidin-1-yl)-2-chloroethan-1-one
The XLogP value of 0.4575 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Azetidin-1-yl)-2-chloroethan-1-one. With a topological polar surface area (TPSA) of 20.31 Ų, 1-(Azetidin-1-yl)-2-chloroethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Azetidin-1-yl)-2-chloroethan-1-one 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-(Azetidin-1-yl)-2-chloroethan-1-one?
The CAS number of 1-(Azetidin-1-yl)-2-chloroethan-1-one is 63177-41-3.
What is the molecular formula of 1-(Azetidin-1-yl)-2-chloroethan-1-one?
The molecular formula of 1-(Azetidin-1-yl)-2-chloroethan-1-one is C5H8ClNO.
What is the molecular weight of 1-(Azetidin-1-yl)-2-chloroethan-1-one?
The molecular weight of 1-(Azetidin-1-yl)-2-chloroethan-1-one is 133.03 g/mol.
Where can I buy 1-(Azetidin-1-yl)-2-chloroethan-1-one?
You can request a quote for 1-(Azetidin-1-yl)-2-chloroethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Azetidin-1-yl)-2-chloroethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(Azetidin-1-yl)-2-chloroethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.