| CAS Number | 1508522-85-7 |
| Catalog Number | AG01AM6Y |
| Chemical Name | [1-(4-Bromo-2-chlorophenyl)cyclopropyl]methanamine |
| IUPAC Name | [1-(4-bromo-2-chlorophenyl)cyclopropyl]methanamine |
| InChI | InChI=1S/C10H11BrClN/c11-7-1-2-8(9(12)5-7)10(6-13)3-4-10/h1-2,5H,3-4,6,13H2 |
| InChI Key | MVHGKZPISMBYQA-UHFFFAOYSA-N |
| MDL Number | MFCD26658124 |
| Molecular Formula | C10H11BrClN |
| Molecular Weight | 260.5580 |
| SMILES | NCC1(C2=C(Cl)C=C(Br)C=C2)CC1 |
| Synonyms | [1-(4-bromo-2-chlorophenyl)cyclopropyl]methanamine,
1508522-85-7,
ZINC84623565,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.559g/mol |
| Monoisotopic Mass | 258.976g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number