2-Fluoro-1-nitro-3-(trifluoromethoxy)benzene - CAS 1365272-87-2
Catalog: |
BB065080 |
Product Name: |
2-Fluoro-1-nitro-3-(trifluoromethoxy)benzene |
CAS: |
1365272-87-2 |
Synonyms: |
2-Fluoro-1-nitro-3-(trifluoromethoxy)benzene |
IUPAC Name: | 2-fluoro-1-nitro-3-(trifluoromethoxy)benzene |
Molecular Weight: | 225.1 |
Molecular Formula: | C7H3F4NO3 |
Canonical SMILES: | C1=CC(=C(C(=C1)OC(F)(F)F)F)[N+](=O)[O-] |
InChI: | InChI=1S/C7H3F4NO3/c8-6-4(12(13)14)2-1-3-5(6)15-7(9,10)11/h1-3H |
InChI Key: | VUOGBZMYTZNXTC-UHFFFAOYSA-N |
Complexity: | 239 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.00490561 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.00490561 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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