| CAS Number | 1016802-55-3 |
| Catalog Number | AG019KQ2 |
| Chemical Name | 2-chloro-N-(2-ethylphenyl)propanamide |
| IUPAC Name | 2-chloro-N-(2-ethylphenyl)propanamide |
| InChI | InChI=1S/C11H14ClNO/c1-3-9-6-4-5-7-10(9)13-11(14)8(2)12/h4-8H,3H2,1-2H3,(H,13,14) |
| InChI Key | LEROANWUUHYKKV-UHFFFAOYSA-N |
| MDL Number | MFCD09949608 |
| Molecular Formula | C11H14ClNO |
| Molecular Weight | 211.6880 |
| SMILES | CCC1=C(NC(C(Cl)C)=O)C=CC=C1 |
| Synonyms | 2-chloro-N-(2-ethylphenyl)propanamide,
1016802-55-3,
SCHEMBL10584522,
AKOS000197479,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 211.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.689g/mol |
| Monoisotopic Mass | 211.076g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
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