| CAS Number | 1153346-83-8 |
| Catalog Number | AG01B2SA |
| Chemical Name | 5-chloro-N-(2-nitrophenyl)pentanamide |
| IUPAC Name | 5-chloro-N-(2-nitrophenyl)pentanamide |
| InChI | InChI=1S/C11H13ClN2O3/c12-8-4-3-7-11(15)13-9-5-1-2-6-10(9)14(16)17/h1-2,5-6H,3-4,7-8H2,(H,13,15) |
| InChI Key | VPSCHUWMOFECCE-UHFFFAOYSA-N |
| MDL Number | MFCD12124253 |
| Molecular Formula | C11H13ClN2O3 |
| Molecular Weight | 256.6855 |
| SMILES | [O-][N+](C1=C(NC(CCCCCl)=O)C=CC=C1)=O |
| Synonyms | 5-chloro-N-(2-nitrophenyl)pentanamide,
1153346-83-8,
ZINC37007119,
|
| Complexity | 268 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 256.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.686g/mol |
| Monoisotopic Mass | 256.061g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 74.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number