| CAS Number | 1609402-76-7 |
| Catalog Number | AG00J3V4(AGN-PC-0WB7R5) |
| Chemical Name | 3-(2-Bromophenoxy)-N-methylpropan-1-amine hydrochloride |
| IUPAC Name | 3-(2-bromophenoxy)-N-methylpropan-1-amine;hydrochloride |
| InChI | InChI=1S/C10H14BrNO.ClH/c1-12-7-4-8-13-10-6-3-2-5-9(10)11;/h2-3,5-6,12H,4,7-8H2,1H3;1H |
| InChI Key | FPFOVKZXPSBDSI-UHFFFAOYSA-N |
| MDL Number | MFCD26959500 |
| Molecular Formula | C10H15BrClNO |
| Molecular Weight | 280.5892 |
| SMILES | C1(=CC=CC=C1OCCCNC)Br.Cl |
| Synonyms | 1609402-76-7,
[3-(2-Bromophenoxy)propyl]methylamine hydrochloride,
3-(2-Bromophenoxy)-N-methylpropan-1-amine hydrochloride,
ZX-CM017444,
MFCD26959500,
AKOS027426650,
|
| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 279.003g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.59g/mol |
| Monoisotopic Mass | 279.003g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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