| CAS Number | 1225856-52-9 |
| Catalog Number | AG01EJ98 |
| Chemical Name | 4-(benzyloxy)-N-propylaniline |
| IUPAC Name | 4-phenylmethoxy-N-propylaniline |
| InChI | InChI=1S/C16H19NO/c1-2-12-17-15-8-10-16(11-9-15)18-13-14-6-4-3-5-7-14/h3-11,17H,2,12-13H2,1H3 |
| InChI Key | UBUXZFVTPVDBMG-UHFFFAOYSA-N |
| MDL Number | MFCD16470344 |
| Molecular Formula | C16H19NO |
| Molecular Weight | 241.3282 |
| SMILES | CCCNC1=CC=C(OCC2=CC=CC=C2)C=C1 |
| Synonyms | SCHEMBL17890843,
4-(BENZYLOXY)-N-PROPYLANILINE,
AKOS005297762,
1225856-52-9,
|
| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.334g/mol |
| Monoisotopic Mass | 241.147g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number