| CAS Number | 56966-37-1 |
| Catalog Number | AG01A2YJ |
| Chemical Name | 3-(2,5-Dimethoxyphenyl)propan-1-amine |
| IUPAC Name | 3-(2,5-dimethoxyphenyl)propan-1-amine |
| InChI | InChI=1S/C11H17NO2/c1-13-10-5-6-11(14-2)9(8-10)4-3-7-12/h5-6,8H,3-4,7,12H2,1-2H3 |
| InChI Key | RTBLTCFCRGIGFB-UHFFFAOYSA-N |
| MDL Number | MFCD00092186 |
| Molecular Formula | C11H17NO2 |
| Molecular Weight | 195.2582 |
| SMILES | COC1=CC(CCCN)=C(OC)C=C1 |
| Synonyms | 3-(2,5-dimethoxyphenyl)propan-1-amine,
56966-37-1,
3-(2,5-DIMETHOXY-PHENYL)-PROPYLAMINE,
SCHEMBL5663448,
RTBLTCFCRGIGFB-UHFFFAOYSA-N,
1926AJ,
ZINC11596900,
AKOS010969726,
AB03308,
gamma-Aminopropyl-2,5-dimethoxybenzene,
NE24204,
gamma-(2,5-Dimethoxy-phenyl)-propylamin,
C11H17NO2,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.262g/mol |
| Monoisotopic Mass | 195.126g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number