| CAS Number | 1231245-16-1 |
| Catalog Number | AG009ZG9 |
| Chemical Name | 1-(2-BROMOPHENYL)PROPAN-1-AMINE |
| IUPAC Name | 1-(2-bromophenyl)propan-1-amine |
| InChI | InChI=1S/C9H12BrN/c1-2-9(11)7-5-3-4-6-8(7)10/h3-6,9H,2,11H2,1H3 |
| InChI Key | XXWZAEMBXBIREN-UHFFFAOYSA-N |
| MDL Number | MFCD16083375 |
| Molecular Formula | C9H12BrN |
| Molecular Weight | 214.1023 |
| SMILES | CCC(C1=C(Br)C=CC=C1)N |
| Synonyms | 1-(2-BROMOPHENYL)PROPAN-1-AMINE,
1231245-16-1,
AKOS010993854,
MCULE-8672371758,
NE46144,
Z1421986541,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.106g/mol |
| Monoisotopic Mass | 213.015g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number