| CAS Number | 72093-49-3 |
| Catalog Number | AG005K8B(AGN-PC-0BGIC0) |
| Chemical Name | 1-Fluoro-3-(4-nitrophenyl)benzene |
| IUPAC Name | 1-fluoro-3-(4-nitrophenyl)benzene |
| InChI | InChI=1S/C12H8FNO2/c13-11-3-1-2-10(8-11)9-4-6-12(7-5-9)14(15)16/h1-8H |
| InChI Key | IYKGFDKPPCITJX-UHFFFAOYSA-N |
| MDL Number | MFCD20529492 |
| Molecular Formula | C12H8FNO2 |
| Molecular Weight | 217.1958 |
| SMILES | Fc1cccc(c1)c1ccc(cc1)[N+](=O)[O-] |
| Synonyms | 1-Fluoro-3-(4-nitrophenyl)benzene,
72093-49-3,
ACMC-209olq,
SCHEMBL12812871,
CTK8B2226,
DTXSID80718393,
3-Fluoro-4'-nitro-1,1'-biphenyl,
ANW-36156,
MFCD20529492,
ZINC74937832,
TC-124901,
V7478,
B-8513,
C12H8FNO2,
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| Complexity | 246 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.199g/mol |
| Monoisotopic Mass | 217.054g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number