| CAS Number | 1049754-73-5 |
| Catalog Number | AG019NR3 |
| Chemical Name | [3-(dimethylamino)propyl][(4-ethoxy-3-methoxyphenyl)methyl]amine dihydrochloride |
| IUPAC Name | N-[(4-ethoxy-3-methoxyphenyl)methyl]-N',N'-dimethylpropane-1,3-diamine;dihydrochloride |
| InChI | InChI=1S/C15H26N2O2.2ClH/c1-5-19-14-8-7-13(11-15(14)18-4)12-16-9-6-10-17(2)3;;/h7-8,11,16H,5-6,9-10,12H2,1-4H3;2*1H |
| InChI Key | UMYINEYWPOSGES-UHFFFAOYSA-N |
| MDL Number | MFCD07109534 |
| Molecular Formula | C15H28Cl2N2O2 |
| Molecular Weight | 339.301 |
| SMILES | Cl.Cl.CCOC1=C(OC)C=C(CNCCCN(C)C)C=C1 |
| Synonyms | [3-(dimethylamino)propyl][(4-ethoxy-3-methoxyphenyl)methyl]amine dihydrochloride,
1049754-73-5,
N'-(4-ethoxy-3-methoxybenzyl)-N,N-dimethylpropane-1,3-diamine dihydrochloride,
AC1Q3AAZ,
CTK6G2529,
MCULE-8067126914,
NE13476,
EN300-11553,
Z56979311,
|
| Complexity | 224 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 338.153g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 339.301g/mol |
| Monoisotopic Mass | 338.153g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 33.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number