| CAS Number | 15211-98-0 |
| Catalog Number | AG00AQHS(AGN-PC-0WOAJU) |
| Chemical Name | 1-(4-Bromophenoxy)-4-fluoro-2-nitrobenzene |
| IUPAC Name | 1-(4-bromophenoxy)-4-fluoro-2-nitrobenzene |
| InChI | InChI=1S/C12H7BrFNO3/c13-8-1-4-10(5-2-8)18-12-6-3-9(14)7-11(12)15(16)17/h1-7H |
| InChI Key | XPSWPTPIDDAPRC-UHFFFAOYSA-N |
| MDL Number | MFCD11135722 |
| Molecular Formula | C12H7BrFNO3 |
| Molecular Weight | 312.0913 |
| SMILES | Brc1ccc(cc1)Oc1ccc(cc1[N+](=O)[O-])F |
| Synonyms | 1-(4-bromophenoxy)-4-fluoro-2-nitrobenzene,
15211-98-0,
SCHEMBL3046905,
XPSWPTPIDDAPRC-UHFFFAOYSA-N,
ZINC19868816,
AKOS000222295,
2-(4-bromophenoxy)-5-fluoronitrobenzene,
V3473,
C12H7BrFNO3,
|
| Complexity | 292 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 310.959g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 312.094g/mol |
| Monoisotopic Mass | 310.959g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number