2-Fluoro-N,N-dimethyl-4-nitroaniline - CAS 65739-04-0
Catalog: |
BB064963 |
Product Name: |
2-Fluoro-N,N-dimethyl-4-nitroaniline |
CAS: |
65739-04-0 |
Synonyms: |
2-fluoro-N,N-dimethyl-4-nitroaniline; (2-Fluoro-4-nitrophenyl)dimethylamine; N,N-Dimethyl-2-fluoro-4-nitroaniline |
IUPAC Name: | 2-fluoro-N,N-dimethyl-4-nitroaniline |
Description: | 2-Fluoro-N,N-dimethyl-4-nitroaniline |
Molecular Weight: | 184.17 |
Molecular Formula: | C8H9FN2O2 |
Canonical SMILES: | CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])F |
InChI: | InChI=1S/C8H9FN2O2/c1-10(2)8-4-3-6(11(12)13)5-7(8)9/h3-5H,1-2H3 |
InChI Key: | QTXUWCWOGLFTTP-UHFFFAOYSA-N |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.0648057 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.0648057 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 49.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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