2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone
TL;DR: 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone (CAS 4593-21-9) is a chemical compound with molecular formula C8H13Cl2NO and molecular weight 209.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dichloro-1-(2-methylpiperidin-1-yl)ethanone
Also Known As: 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone, 2,2-dichloro-1-(2-methylpiperidin-1-yl)ethanone, 2,2-dichloro-1-(2-methyl-1-piperidyl)ethanone, 2,2-Dichloro-1-(2-methylpiperidin-1-yl)ethan-1-one, RefChem:243149
| Molecular Formula | C8H13Cl2NO |
|---|---|
| Molecular Weight | 209.04 g/mol |
| LogP | 2.1911 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.03741 |
| Heavy Atoms | 12 |
| Complexity | 172.4408 |
Chemical Identifiers
| CAS Number | 4593-21-9 |
|---|---|
| SMILES | CC1CCCCN1C(=O)C(Cl)Cl |
Product Overview
2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone (CAS 4593-21-9), with molecular formula C8H13Cl2NO and molecular weight 209.04 g/mol. IUPAC: 2,2-dichloro-1-(2-methylpiperidin-1-yl)ethanone.
Chemical Property Profile of 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone
Property Insights of 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone
The XLogP value of 2.1911 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone. With a topological polar surface area (TPSA) of 20.31 Ų, 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone 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 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone?
The CAS number of 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone is 4593-21-9.
What is the molecular formula of 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone?
The molecular formula of 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone is C8H13Cl2NO.
What is the molecular weight of 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone?
The molecular weight of 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone is 209.04 g/mol.
Where can I buy 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone?
You can request a quote for 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dichloro-1-(2-methyl-1-piperidinyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.