| CAS Number | 1158576-13-6 |
| Catalog Number | AG01AARQ |
| Chemical Name | N-[(5-bromo-2-ethoxyphenyl)methyl]cyclopropanamine hydrochloride |
| IUPAC Name | N-[(5-bromo-2-ethoxyphenyl)methyl]cyclopropanamine;hydrochloride |
| InChI | InChI=1S/C12H16BrNO.ClH/c1-2-15-12-6-3-10(13)7-9(12)8-14-11-4-5-11;/h3,6-7,11,14H,2,4-5,8H2,1H3;1H |
| InChI Key | GEFUNHDYUMWJEX-UHFFFAOYSA-N |
| MDL Number | MFCD07112080 |
| Molecular Formula | C12H17BrClNO |
| Molecular Weight | 306.6265 |
| SMILES | Cl.CCOC1=C(CNC2CC2)C=C(Br)C=C1 |
| Synonyms | N-[(5-bromo-2-ethoxyphenyl)methyl]cyclopropanamine hydrochloride,
1158576-13-6,
AC1Q39YJ,
AKOS008040986,
MCULE-6937547264,
NE28662,
EN300-69388,
|
| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 305.018g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 306.628g/mol |
| Monoisotopic Mass | 305.018g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number