| CAS Number | 1492317-53-9 |
| Catalog Number | AG01AWC7 |
| Chemical Name | [(2-Bromo-5-chlorophenyl)methyl](2-methylpropyl)amine |
| IUPAC Name | N-[(2-bromo-5-chlorophenyl)methyl]-2-methylpropan-1-amine |
| InChI | InChI=1S/C11H15BrClN/c1-8(2)6-14-7-9-5-10(13)3-4-11(9)12/h3-5,8,14H,6-7H2,1-2H3 |
| InChI Key | RUKZIYQOTKFCRW-UHFFFAOYSA-N |
| MDL Number | MFCD21705593 |
| Molecular Formula | C11H15BrClN |
| Molecular Weight | 276.6005 |
| SMILES | CC(CNCC1=C(Br)C=CC(Cl)=C1)C |
| Synonyms | [(2-bromo-5-chlorophenyl)methyl](2-methylpropyl)amine,
1492317-53-9,
ZINC85219864,
AKOS015501754,
BBV-41462326,
EN300-162317,
|
| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.008g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 276.602g/mol |
| Monoisotopic Mass | 275.008g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number