| CAS Number | 1609408-87-8 |
| Catalog Number | AG00J3MZ |
| Chemical Name | N-(3-ethoxy-4-methoxybenzyl)cyclohexanamine hydrobromide |
| IUPAC Name | N-[(3-ethoxy-4-methoxyphenyl)methyl]cyclohexanamine;hydrobromide |
| InChI | InChI=1S/C16H25NO2.BrH/c1-3-19-16-11-13(9-10-15(16)18-2)12-17-14-7-5-4-6-8-14;/h9-11,14,17H,3-8,12H2,1-2H3;1H |
| InChI Key | GYDCHEXUCOLFSQ-UHFFFAOYSA-N |
| MDL Number | MFCD13186504 |
| Molecular Formula | C16H26BrNO2 |
| Molecular Weight | 344.2871 |
| SMILES | C1(OCC)=CC(=CC=C1OC)CNC1CCCCC1.Br |
| Synonyms | N-(3-ethoxy-4-methoxybenzyl)cyclohexanamine hydrobromide,
1609408-87-8,
ZX-CM015889,
MFCD13186504,
355817-14-0,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 343.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 344.293g/mol |
| Monoisotopic Mass | 343.115g/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