| CAS Number | 39860-72-5 |
| Catalog Number | AG01DWEJ |
| Chemical Name | N-Benzyl-4-(benzyloxy)aniline |
| IUPAC Name | N-benzyl-4-phenylmethoxyaniline |
| InChI | InChI=1S/C20H19NO/c1-3-7-17(8-4-1)15-21-19-11-13-20(14-12-19)22-16-18-9-5-2-6-10-18/h1-14,21H,15-16H2 |
| InChI Key | XEKSKHQCXAWZNO-UHFFFAOYSA-N |
| MDL Number | MFCD16470341 |
| Molecular Formula | C20H19NO |
| Molecular Weight | 289.3710 |
| SMILES | C(C1=CC=CC=C1)NC1=CC=C(OCC2=CC=CC=C2)C=C1 |
| Synonyms | N-Benzyl-4-(benzyloxy)aniline,
39860-72-5,
SCHEMBL11838896,
AKOS005297780,
|
| Complexity | 286 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 289.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 289.378g/mol |
| Monoisotopic Mass | 289.147g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number