4-Fluoro-N-methyl-3-nitrobenzamide - CAS 475216-25-2
Catalog: |
BB065161 |
Product Name: |
4-Fluoro-N-methyl-3-nitrobenzamide |
CAS: |
475216-25-2 |
Synonyms: |
4-fluoro-N-methyl-3-nitrobenzamide; 4-fluoro-3-nitro-N-methylbenzamide; 4-Fluoro-N-methyl-3-nitro-benzamide; Benzamide, 4-fluoro-N-methyl-3-nitro- |
IUPAC Name: | 4-fluoro-N-methyl-3-nitrobenzamide |
Description: | 4-Fluoro-N-methyl-3-nitrobenzamide |
Molecular Weight: | 198.15 |
Molecular Formula: | C8H7FN2O3 |
Canonical SMILES: | CNC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-] |
InChI: | InChI=1S/C8H7FN2O3/c1-10-8(12)5-2-3-6(9)7(4-5)11(13)14/h2-4H,1H3,(H,10,12) |
InChI Key: | LTGYDUQSOZFFEM-UHFFFAOYSA-N |
Complexity: | 241 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.04407025 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.04407025 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 74.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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