Cas no 178686-77-6 (6-(4-Hexylphenyl)-6-oxohexanoic acid)

6-(4-Hexylphenyl)-6-oxohexanoic acid structure
178686-77-6 structure
Product Name:6-(4-Hexylphenyl)-6-oxohexanoic acid
CAS No:178686-77-6
MF:C18H26O3
MW:290.397245883942
CID:906668
PubChem ID:15295561
Update Time:2025-04-19

6-(4-Hexylphenyl)-6-oxohexanoic acid Chemical and Physical Properties

Names and Identifiers

    • 6-(4-HEXYLPHENYL)-6-OXOHEXANOIC ACID
    • AG-E-28844
    • AGN-PC-00OT4Y
    • CTK4D6854
    • KB-198826
    • SureCN9076086
    • MFCD02260971
    • HBVPJPCDSQNIBL-UHFFFAOYSA-N
    • Benzenehexanoic acid, 4-hexyl-epsilon-oxo-
    • DTXSID60571105
    • SCHEMBL9076086
    • 178686-77-6
    • AKOS016022767
    • 5-(4-n-hexylbenzoyl)pentanoic acid
    • 6-(4-HEXYLPHENYL)-6-OXOHEXANOICACID
    • 6-(4-Hexylphenyl)-6-oxohexanoic acid
    • MDL: MFCD02260971
    • Inchi: 1S/C18H26O3/c1-2-3-4-5-8-15-11-13-16(14-12-15)17(19)9-6-7-10-18(20)21/h11-14H,2-10H2,1H3,(H,20,21)
    • InChI Key: HBVPJPCDSQNIBL-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC(=CC=1)CCCCCC)CCCCC(=O)O

Computed Properties

  • Exact Mass: 290.18800
  • Monoisotopic Mass: 290.18819469g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 11
  • Complexity: 304
  • 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: 4.7
  • Topological Polar Surface Area: 54.4?2

Experimental Properties

  • PSA: 54.37000
  • LogP: 4.63710

6-(4-Hexylphenyl)-6-oxohexanoic 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%

6-(4-Hexylphenyl)-6-oxohexanoic acid Pricemore >>

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