| CAS Number | 790263-80-8 |
| Catalog Number | AG019JP8 |
| Chemical Name | 2-(2-chloroacetamido)-N-cyclopropylbenzamide |
| IUPAC Name | 2-[(2-chloroacetyl)amino]-N-cyclopropylbenzamide |
| InChI | InChI=1S/C12H13ClN2O2/c13-7-11(16)15-10-4-2-1-3-9(10)12(17)14-8-5-6-8/h1-4,8H,5-7H2,(H,14,17)(H,15,16) |
| InChI Key | ZRRVGQRDHXTKRU-UHFFFAOYSA-N |
| MDL Number | MFCD06357434 |
| Molecular Formula | C12H13ClN2O2 |
| Molecular Weight | 252.6968 |
| SMILES | ClCC(NC1=C(C(NC2CC2)=O)C=CC=C1)=O |
| Synonyms | 2-(2-chloroacetamido)-N-cyclopropylbenzamide,
790263-80-8,
2-[(chloroacetyl)amino]-N-cyclopropylbenzamide,
AC1MZ5PT,
AC1Q3TKF,
CTK6H5616,
ZINC3888000,
AKOS000117858,
MCULE-5402272345,
NE36921,
EN300-10034,
2-[(2-chloroacetyl)amino]-N-cyclopropylbenzamide,
ZINC03888000,
CID3867401,
|
| Complexity | 305 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.698g/mol |
| Monoisotopic Mass | 252.067g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number