| CAS Number | 1609395-90-5 |
| Catalog Number | AG00J3OL |
| Chemical Name | (4-methoxybenzyl)(4-nitrobenzyl)amine hydrobromide |
| IUPAC Name | N-[(4-methoxyphenyl)methyl]-1-(4-nitrophenyl)methanamine;hydrobromide |
| InChI | InChI=1S/C15H16N2O3.BrH/c1-20-15-8-4-13(5-9-15)11-16-10-12-2-6-14(7-3-12)17(18)19;/h2-9,16H,10-11H2,1H3;1H |
| InChI Key | RVHZYZVSKJHHHD-UHFFFAOYSA-N |
| MDL Number | MFCD13186461 |
| Molecular Formula | C15H17BrN2O3 |
| Molecular Weight | 353.2111 |
| SMILES | [N+](=O)([O-])C1=CC=C(C=C1)CNCC1C=CC(OC)=CC=1.Br |
| Synonyms | (4-methoxybenzyl)(4-nitrobenzyl)amine hydrobromide,
1609395-90-5,
ZX-CM015861,
MFCD13186461,
418784-70-0,
|
| Complexity | 290 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 352.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 353.216g/mol |
| Monoisotopic Mass | 352.042g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 67.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number