| CAS Number | 215712-11-1 |
| Catalog Number | AG00I46M(AGN-PC-09RYKR) |
| Chemical Name | 4-(Benzyloxy)-2-bromoaniline |
| IUPAC Name | 2-bromo-4-phenylmethoxyaniline |
| InChI | InChI=1S/C13H12BrNO/c14-12-8-11(6-7-13(12)15)16-9-10-4-2-1-3-5-10/h1-8H,9,15H2 |
| InChI Key | AFMNBZDOIKPUMR-UHFFFAOYSA-N |
| MDL Number | MFCD15527707 |
| Molecular Formula | C13H12BrNO |
| Molecular Weight | 278.1445 |
| SMILES | Nc1ccc(cc1Br)OCc1ccccc1 |
| Synonyms | 4-(Benzyloxy)-2-bromoaniline,
215712-11-1,
SCHEMBL7447794,
MFCD15527707,
ZINC74938182,
|
| Complexity | 206 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 277.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.149g/mol |
| Monoisotopic Mass | 277.01g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number