| CAS Number | 1027643-27-1 |
| Catalog Number | AG00VWK2(AGN-PC-0WBL17) |
| Chemical Name | 2-Chloro-n-(4-[ethyl(isopropyl)amino]phenyl)acetamide hydrochloride |
| IUPAC Name | 2-chloro-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide;hydrochloride |
| InChI | InChI=1S/C13H19ClN2O.ClH/c1-4-16(10(2)3)12-7-5-11(6-8-12)15-13(17)9-14;/h5-8,10H,4,9H2,1-3H3,(H,15,17);1H |
| InChI Key | NAWIFQYVUQWTHF-UHFFFAOYSA-N |
| MDL Number | MFCD08143663 |
| Molecular Formula | C13H20Cl2N2O |
| Molecular Weight | 291.2167 |
| SMILES | Cl.CCN(C1=CC=C(NC(CCl)=O)C=C1)C(C)C |
| Synonyms | 1027643-27-1,
2-chloro-N-{4-[ethyl(propan-2-yl)amino]phenyl}acetamide hydrochloride,
2-chloro-N-{4-[ethyl(isopropyl)amino]phenyl}acetamide hydrochloride,
AC1Q39RJ,
CTK6E7349,
SBB016597,
AKOS015948965,
MCULE-9527877414,
NE20914,
EN300-01588,
2-chloro-N-{4-[ethyl(methylethyl)amino]phenyl}acetamide, chloride,
|
| Complexity | 238 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 290.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 291.216g/mol |
| Monoisotopic Mass | 290.095g/mol |
| Rotatable Bond Count | 5 |
| 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