| CAS Number | 1096303-75-1 |
| Catalog Number | AG00949U(AGN-PC-0WA588) |
| Chemical Name | 2-(Benzyloxy)-3-bromo-5-fluoroaniline |
| IUPAC Name | 3-bromo-5-fluoro-2-phenylmethoxyaniline |
| InChI | InChI=1S/C13H11BrFNO/c14-11-6-10(15)7-12(16)13(11)17-8-9-4-2-1-3-5-9/h1-7H,8,16H2 |
| InChI Key | BRWDOSSHMJXEOM-UHFFFAOYSA-N |
| MDL Number | MFCD12408888 |
| Molecular Formula | C13H11BrFNO |
| Molecular Weight | 296.1349 |
| SMILES | Fc1cc(N)c(c(c1)Br)OCc1ccccc1 |
| Synonyms | 2-(BENZYLOXY)-3-BROMO-5-FLUOROANILINE,
1096303-75-1,
KM3579,
ZINC37250566,
AKOS009113743,
Z7282,
C13H11BrFNO,
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| Complexity | 236 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 295.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 296.139g/mol |
| Monoisotopic Mass | 295.001g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number