| CAS Number | 1098347-69-3 |
| Catalog Number | AG019KS3 |
| Chemical Name | N-[(4-bromophenyl)methyl]-2-chloro-N-methylpropanamide |
| IUPAC Name | N-[(4-bromophenyl)methyl]-2-chloro-N-methylpropanamide |
| InChI | InChI=1S/C11H13BrClNO/c1-8(13)11(15)14(2)7-9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3 |
| InChI Key | ORFIDLNLRMDEJZ-UHFFFAOYSA-N |
| MDL Number | MFCD11643915 |
| Molecular Formula | C11H13BrClNO |
| Molecular Weight | 290.584 |
| SMILES | CC(C(N(CC1=CC=C(Br)C=C1)C)=O)Cl |
| Synonyms | N-[(4-bromophenyl)methyl]-2-chloro-N-methylpropanamide,
1098347-69-3,
AKOS009131053,
NE33796,
EN300-28170,
AC1Q2AT8,
|
| Complexity | 217 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 288.9869g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 290.58g/mol |
| Monoisotopic Mass | 288.9869g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 20.3Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number