2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone
TL;DR: 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone (CAS 400088-75-7) is a chemical compound with molecular formula C13H14ClF2NO3 and molecular weight 305.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-2-methylphenoxy)-2,2-difluoro-1-morpholin-4-ylethanone
Also Known As: 2-(4-chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone, 2-(4-chloro-2-methylphenoxy)-2,2-difluoro-1-(morpholin-4-yl)ethan-1-one, 2-(4-chloro-2-methylphenoxy)-2,2-difluoro-1-morpholin-4-ylethanone, 2-(4-chloro-2-methyl-phenoxy)-2,2-difluoro-1-morpholino-ethanone, 2-(4-chloro-2-methyl-phenoxy)-2,2-difluoro-1-morpholin-4-yl-ethanone
| Molecular Formula | C13H14ClF2NO3 |
|---|---|
| Molecular Weight | 305.06 g/mol |
| LogP | 2.47882 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.06302 |
| Heavy Atoms | 20 |
| Complexity | 504.38968 |
Chemical Identifiers
| CAS Number | 400088-75-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)Cl)OC(C(=O)N2CCOCC2)(F)F |
Product Overview
2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone (CAS 400088-75-7), with molecular formula C13H14ClF2NO3 and molecular weight 305.06 g/mol. IUPAC: 2-(4-chloro-2-methylphenoxy)-2,2-difluoro-1-morpholin-4-ylethanone.
Chemical Property Profile of 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone
Property Insights of 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone
The XLogP value of 2.47882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone. With a topological polar surface area (TPSA) of 38.77 Ų, 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone 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-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone?
The CAS number of 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone is 400088-75-7.
What is the molecular formula of 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone?
The molecular formula of 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone is C13H14ClF2NO3.
What is the molecular weight of 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone?
The molecular weight of 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone is 305.06 g/mol.
Where can I buy 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone?
You can request a quote for 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chloro-2-methylphenoxy)-2,2-difluoro-1-morpholino-1-ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.