| CAS Number | 391220-24-9 |
| Catalog Number | AG019MO5 |
| Chemical Name | 2-bromo-N-(2-chlorophenyl)-3-methylbutanamide |
| IUPAC Name | 2-bromo-N-(2-chlorophenyl)-3-methylbutanamide |
| InChI | InChI=1S/C11H13BrClNO/c1-7(2)10(12)11(15)14-9-6-4-3-5-8(9)13/h3-7,10H,1-2H3,(H,14,15) |
| InChI Key | TUPIKAJNTKNZCO-UHFFFAOYSA-N |
| MDL Number | MFCD04406119 |
| Molecular Formula | C11H13BrClNO |
| Molecular Weight | 290.5840 |
| SMILES | CC(C(C(NC1=C(Cl)C=CC=C1)=O)Br)C |
| Synonyms | 2-bromo-N-(2-chlorophenyl)-3-methylbutanamide,
391220-24-9,
AC1N5AGZ,
AC1Q1NZW,
CTK6A3618,
AKOS000153928,
AKOS016903648,
MCULE-1582856762,
NE26399,
EN300-36783,
SR-01000004837,
SR-01000004837-1,
F0076-0015,
ZINC04031985,
CID4168596,
|
| Complexity | 223 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 288.987g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 290.585g/mol |
| Monoisotopic Mass | 288.987g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number