| CAS Number | 1171407-18-3 |
| Catalog Number | AG019P86 |
| Chemical Name | 2-chloro-N-{[4-(dimethylamino)phenyl]methyl}-N-methylacetamide hydrochloride |
| IUPAC Name | 2-chloro-N-[[4-(dimethylamino)phenyl]methyl]-N-methylacetamide;hydrochloride |
| InChI | InChI=1S/C12H17ClN2O.ClH/c1-14(2)11-6-4-10(5-7-11)9-15(3)12(16)8-13;/h4-7H,8-9H2,1-3H3;1H |
| InChI Key | AEVAMYDLPHMGIX-UHFFFAOYSA-N |
| MDL Number | MFCD09336174 |
| Molecular Formula | C12H18Cl2N2O |
| Molecular Weight | 277.1901 |
| SMILES | Cl.CN(C1=CC=C(CN(C(CCl)=O)C)C=C1)C |
| Synonyms | 2-chloro-N-{[4-(dimethylamino)phenyl]methyl}-N-methylacetamide hydrochloride,
1171407-18-3,
2-chloro-N-[4-(dimethylamino)benzyl]-N-methylacetamide hydrochloride,
AC1Q3BKJ,
CTK6H4893,
AKOS030740683,
MCULE-5386310726,
NE14255,
EN300-22608,
|
| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 276.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.189g/mol |
| Monoisotopic Mass | 276.08g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 23.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number