| CAS Number | 83979-31-1 |
| Catalog Number | AG019Y62 |
| Chemical Name | [3-(3,4-Dimethoxyphenyl)propyl](methyl)amine hydrochloride |
| IUPAC Name | 3-(3,4-dimethoxyphenyl)-N-methylpropan-1-amine;hydrochloride |
| InChI | InChI=1S/C12H19NO2.ClH/c1-13-8-4-5-10-6-7-11(14-2)12(9-10)15-3;/h6-7,9,13H,4-5,8H2,1-3H3;1H |
| InChI Key | LPGPMTQUNLQRCN-UHFFFAOYSA-N |
| MDL Number | MFCD14705669 |
| Molecular Formula | C12H20ClNO2 |
| Molecular Weight | 245.7457 |
| SMILES | Cl.CNCCCC1=CC(OC)=C(OC)C=C1 |
| Synonyms | [3-(3,4-dimethoxyphenyl)propyl](methyl)amine hydrochloride,
83979-31-1,
AC1Q3BTT,
NE52816,
EN300-57177,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.118g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 245.747g/mol |
| Monoisotopic Mass | 245.118g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 30.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number