Cas no 1261996-91-1 (3-(3-Acetylphenyl)-5-fluorobenzoic acid)

3-(3-Acetylphenyl)-5-fluorobenzoic acid structure
1261996-91-1 structure
Product Name:3-(3-Acetylphenyl)-5-fluorobenzoic acid
CAS No:1261996-91-1
MF:C15H11FO3
MW:258.244447946548
MDL:MFCD18320101
CID:1024659
PubChem ID:53226013
Update Time:2025-09-28

3-(3-Acetylphenyl)-5-fluorobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3'-Acetyl-5-fluoro-[1,1'-biphenyl]-3-carboxylic acid
    • 3-(3-acetylphenyl)-5-fluorobenzoic acid
    • 3'-Acetyl-5-fluoro[1,1'-biphenyl]-3-carboxylic acid
    • SCHEMBL2557078
    • [1,1'-Biphenyl]-3-carboxylic acid, 3'-acetyl-5-fluoro-
    • BS-20377
    • 3'-Acetyl-5-fluoro-[1,1'-biphenyl]-3-carboxylicacid
    • A889503
    • MFCD18320101
    • AKOS015888586
    • DTXSID70689745
    • 1261996-91-1
    • 3-(3-Acetylphenyl)-5-fluorobenzoic acid
    • MDL: MFCD18320101
    • Inchi: 1S/C15H11FO3/c1-9(17)10-3-2-4-11(5-10)12-6-13(15(18)19)8-14(16)7-12/h2-8H,1H3,(H,18,19)
    • InChI Key: BHKFBSPXVATODO-UHFFFAOYSA-N
    • SMILES: FC1C=C(C(=O)O)C=C(C=1)C1C=CC=C(C(C)=O)C=1

Computed Properties

  • Exact Mass: 258.06900
  • Monoisotopic Mass: 258.06922237g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 3
  • Complexity: 355
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.9
  • Topological Polar Surface Area: 54.4?2

Experimental Properties

  • Density: 1.3±0.1 g/cm3
  • Boiling Point: 469.5±40.0 °C at 760 mmHg
  • Flash Point: 237.7±27.3 °C
  • PSA: 54.37000
  • LogP: 3.39350
  • Vapor Pressure: 0.0±1.2 mmHg at 25°C

3-(3-Acetylphenyl)-5-fluorobenzoic acid Security Information

3-(3-Acetylphenyl)-5-fluorobenzoic acid Customs Data

  • HS CODE:2918300090
  • Customs Data:

    China Customs Code:

    2918300090

    Overview:

    2918300090 Other aldehydes or ketones without other oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:6.5%.General tariff:30.0%

3-(3-Acetylphenyl)-5-fluorobenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
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3'-Acetyl-5-fluoro-[1,1'-biphenyl]-3-carboxylic acid
1261996-91-1 95%
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£76.00 2022-02-28
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3'-Acetyl-5-fluoro-[1,1'-biphenyl]-3-carboxylic acid
1261996-91-1 95%
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998.00 USD 2021-06-17
abcr
AB327251-1g
3-(3-Acetylphenyl)-5-fluorobenzoic acid, 98%; .
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€144.00 2025-04-21
abcr
AB327251-5g
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