| CAS Number | 895664-33-2 |
| Catalog Number | AG003ZBX(AGN-PC-0VP8F8) |
| Chemical Name | 3-chloro-N-(4-fluoro-2-methylphenyl)propanamide |
| IUPAC Name | 3-chloro-N-(4-fluoro-2-methylphenyl)propanamide |
| InChI | InChI=1S/C10H11ClFNO/c1-7-6-8(12)2-3-9(7)13-10(14)4-5-11/h2-3,6H,4-5H2,1H3,(H,13,14) |
| InChI Key | NFISQKZNVKJGQW-UHFFFAOYSA-N |
| MDL Number | MFCD08077757 |
| Molecular Formula | C10H11ClFNO |
| Molecular Weight | 215.6518 |
| SMILES | N(C(=O)CCCl)C1C=CC(=CC=1C)F |
| Synonyms | 3-chloro-N-(4-fluoro-2-methylphenyl)propanamide,
895664-33-2,
Propanamide,3-chloro-N-(4-fluoro-2-methylphenyl)-,
CTK5G3259,
DTXSID10588420,
CHEMBRDG-BB 9070489,
ALBB-003550,
2360AF,
BBL017761,
MFCD08077757,
STK482316,
ZINC13322618,
AKOS000138430,
MCULE-4608444087,
AJ-63620,
ST45135936,
Y-3690,
C10H11ClFNO,
CHEMBRDG-BB9070489,
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| Complexity | 201 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.652g/mol |
| Monoisotopic Mass | 215.051g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number