2-Fluoro-4-(2-nitrophenyl)benzoic acid - CAS 1365272-19-0
Catalog: |
BB056119 |
Product Name: |
2-Fluoro-4-(2-nitrophenyl)benzoic acid |
CAS: |
1365272-19-0 |
Synonyms: |
2-Fluoro-4-(2-nitrophenyl)benzoic acid; 2-Fluoro-4-(2-nitrophenyl)benzoicacid; 3-Fluoro-2'-nitro[1,1'-biphenyl]-4-carboxylic acid |
IUPAC Name: | 2-fluoro-4-(2-nitrophenyl)benzoic acid |
Description: | 2-Fluoro-4-(2-nitrophenyl)benzoic acid |
Molecular Weight: | 261.21 |
Molecular Formula: | C13H8FNO4 |
Canonical SMILES: | C1=CC=C(C(=C1)C2=CC(=C(C=C2)C(=O)O)F)[N+](=O)[O-] |
InChI: | InChI=1S/C13H8FNO4/c14-11-7-8(5-6-10(11)13(16)17)9-3-1-2-4-12(9)15(18)19/h1-7H,(H,16,17) |
InChI Key: | GZYAYZLFCWPXPY-UHFFFAOYSA-N |
Complexity: | 357 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 261.0437359 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 261.0437359 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 83.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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