4-Acetyl-3'-fluoro-4'-methylbiphenyl - CAS 1345471-18-2
Catalog: |
BB054853 |
Product Name: |
4-Acetyl-3'-fluoro-4'-methylbiphenyl |
CAS: |
1345471-18-2 |
Synonyms: |
4-Acetyl-3'-fluoro-4'-methylbiphenyl; 1-[4-(3-fluoro-4-methylphenyl)phenyl]ethanone |
IUPAC Name: | 1-[4-(3-fluoro-4-methylphenyl)phenyl]ethanone |
Description: | 4-Acetyl-3'-fluoro-4'-methylbiphenyl |
Molecular Weight: | 228.26 |
Molecular Formula: | C15H13FO |
Canonical SMILES: | CC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)C)F |
InChI: | InChI=1S/C15H13FO/c1-10-3-4-14(9-15(10)16)13-7-5-12(6-8-13)11(2)17/h3-9H,1-2H3 |
InChI Key: | YTYXPYVWTUVHDM-UHFFFAOYSA-N |
Complexity: | 268 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 228.095043196 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 228.095043196 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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