| CAS Number | 1049756-51-5 |
| Catalog Number | AG019PCJ |
| Chemical Name | 2-chloro-N-{3-[methyl(phenyl)amino]propyl}acetamide hydrochloride |
| IUPAC Name | 2-chloro-N-[3-(N-methylanilino)propyl]acetamide;hydrochloride |
| InChI | InChI=1S/C12H17ClN2O.ClH/c1-15(11-6-3-2-4-7-11)9-5-8-14-12(16)10-13;/h2-4,6-7H,5,8-10H2,1H3,(H,14,16);1H |
| InChI Key | WLYCKEYXWMYXTF-UHFFFAOYSA-N |
| MDL Number | MFCD07838449 |
| Molecular Formula | C12H18Cl2N2O |
| Molecular Weight | 277.1901 |
| SMILES | Cl.CN(C1=CC=CC=C1)CCCNC(CCl)=O |
| Synonyms | 2-chloro-N-{3-[methyl(phenyl)amino]propyl}acetamide hydrochloride,
1049756-51-5,
AC1Q3BM8,
CTK6H5925,
AKOS030639132,
MCULE-3993308394,
NE22210,
EN300-23211,
2-chloro-n-(3-[methyl(phenyl)amino]propyl)acetamide hydrochloride,
|
| Complexity | 205 |
| 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 | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 277.189g/mol |
| Monoisotopic Mass | 276.08g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number