| CAS Number | 1241676-71-0 |
| Catalog Number | AG009Z9U(AGN-PC-0WNOEM) |
| Chemical Name | (R)-1-(3,5-Dimethoxyphenyl)ethanamine |
| IUPAC Name | (1R)-1-(3,5-dimethoxyphenyl)ethanamine |
| InChI | InChI=1S/C10H15NO2/c1-7(11)8-4-9(12-2)6-10(5-8)13-3/h4-7H,11H2,1-3H3/t7-/m1/s1 |
| InChI Key | BVAAZZHQLIEDTA-SSDOTTSWSA-N |
| MDL Number | MFCD06762263 |
| Molecular Formula | C10H15NO2 |
| Molecular Weight | 181.2316 |
| SMILES | COC=1C=C(C=C(C1)OC)[C@@H](C)N |
| Synonyms | (R)-1-(3,5-dimethoxyphenyl)ethanamine,
1241676-71-0,
1257106-72-1,
(1R)-1-(3,5-dimethoxyphenyl)ethanamine,
CTK5H9214,
ANW-44754,
MFCD06762263,
ZINC34077605,
AKOS015851965,
AS-55158,
TC-066115,
FT-0084309,
B-2085,
A845703,
I01-6072,
ACN-030735,
(R)-1-(3,5-Dimethoxyphenyl)ethanamine hydrochloride,
97294-78-5,
|
| Complexity | 140 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.235g/mol |
| Monoisotopic Mass | 181.11g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number