| CAS Number | 941226-37-5 |
| Catalog Number | AG019PPF |
| Chemical Name | 2-chloro-N-[1-(4-fluorophenyl)ethyl]-N-methylacetamide |
| IUPAC Name | 2-chloro-N-[1-(4-fluorophenyl)ethyl]-N-methylacetamide |
| InChI | InChI=1S/C11H13ClFNO/c1-8(14(2)11(15)7-12)9-3-5-10(13)6-4-9/h3-6,8H,7H2,1-2H3 |
| InChI Key | CGHDTEQFSRLNFA-UHFFFAOYSA-N |
| MDL Number | MFCD09403618 |
| Molecular Formula | C11H13ClFNO |
| Molecular Weight | 229.6784 |
| SMILES | CC(C1=CC=C(F)C=C1)N(C(CCl)=O)C |
| Synonyms | 2-chloro-N-[1-(4-fluorophenyl)ethyl]-N-methylacetamide,
941226-37-5,
AC1Q2B4G,
CTK6H4776,
AKOS009096515,
MCULE-7204435252,
NE14267,
EN300-24643,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.679g/mol |
| Monoisotopic Mass | 229.067g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
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Certificate of Analysis
Lot Number