| CAS Number | 747411-56-9 |
| Catalog Number | AG00FC49 |
| Chemical Name | 4-(2-chloroacetamido)-N,N-dimethylbenzamide |
| IUPAC Name | 4-[(2-chloroacetyl)amino]-N,N-dimethylbenzamide |
| InChI | InChI=1S/C11H13ClN2O2/c1-14(2)11(16)8-3-5-9(6-4-8)13-10(15)7-12/h3-6H,7H2,1-2H3,(H,13,15) |
| InChI Key | DDTWPYQAIJYIGK-UHFFFAOYSA-N |
| MDL Number | MFCD05270923 |
| Molecular Formula | C11H13ClN2O2 |
| Molecular Weight | 240.6861 |
| SMILES | O=C(N(C)C)C1=CC=C(NC(CCl)=O)C=C1 |
| Synonyms | 4-[(chloroacetyl)amino]-N,N-dimethylbenzamide,
4-(2-chloroacetamido)-N,N-dimethylbenzamide,
747411-56-9,
AC1M1RTA,
AC1Q3VYA,
CTK6H5462,
ZINC2641185,
AKOS001052842,
MCULE-2930770841,
NE13058,
EN300-09553,
4-[(2-chloroacetyl)amino]-N,N-dimethylbenzamide,
J-514209,
ZINC02641185,
CID2104083,
|
| Complexity | 261 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.687g/mol |
| Monoisotopic Mass | 240.067g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 49.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number