2-Fluoro-4-acetamidoacetophenone - CAS 112279-55-7
Catalog: |
BB056083 |
Product Name: |
2-Fluoro-4-acetamidoacetophenone |
CAS: |
112279-55-7 |
Synonyms: |
N-(4-ACETYL-3-FLUOROPHENYL)ACETAMIDE; n-(4-acetyl-3-fluoro-phenyl)-acetamide; N-(4-ethanoyl-3-fluoranyl-phenyl)ethanamide |
IUPAC Name: | N-(4-acetyl-3-fluorophenyl)acetamide |
Molecular Weight: | 195.19 |
Molecular Formula: | C10H10FNO2 |
Canonical SMILES: | CC(=O)C1=C(C=C(C=C1)NC(=O)C)F |
InChI: | InChI=1S/C10H10FNO2/c1-6(13)9-4-3-8(5-10(9)11)12-7(2)14/h3-5H,1-2H3,(H,12,14) |
InChI Key: | UIGNOZXFBHBXCU-UHFFFAOYSA-N |
Complexity: | 242 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.06955672 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.06955672 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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