| CAS Number | 1609403-96-4 |
| Catalog Number | AG00J3R4 |
| Chemical Name | N-(2-chlorobenzyl)-2-(4-methoxyphenyl)ethanamine hydrobromide |
| IUPAC Name | N-[(2-chlorophenyl)methyl]-2-(4-methoxyphenyl)ethanamine;hydrobromide |
| InChI | InChI=1S/C16H18ClNO.BrH/c1-19-15-8-6-13(7-9-15)10-11-18-12-14-4-2-3-5-16(14)17;/h2-9,18H,10-12H2,1H3;1H |
| InChI Key | IKZXAUIXAIWLAR-UHFFFAOYSA-N |
| MDL Number | MFCD13186570 |
| Molecular Formula | C16H19BrClNO |
| Molecular Weight | 356.6852 |
| SMILES | C1(=CC=CC=C1Cl)CNCCC1C=CC(OC)=CC=1.Br |
| Synonyms | N-(2-chlorobenzyl)-2-(4-methoxyphenyl)ethanamine hydrobromide,
1609403-96-4,
ZX-CM016346,
MFCD13186570,
353772-55-1,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 355.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 356.688g/mol |
| Monoisotopic Mass | 355.034g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number