Cas no 336-61-8 (Heptafluorobutyranilide)

Heptafluorobutyranilide is a fluorinated anilide derivative characterized by its heptafluorobutyryl functional group. This compound is notable for its high thermal and chemical stability, attributed to the strong electron-withdrawing properties of the perfluorinated chain. It finds utility as a derivatization agent in analytical chemistry, particularly in gas chromatography (GC) and mass spectrometry (MS), where it enhances the volatility and detectability of target analytes. The presence of seven fluorine atoms also improves sensitivity in electron-capture detection (ECD). Its robust structure ensures minimal degradation under harsh conditions, making it suitable for precise quantitative analyses. Applications include pesticide residue testing, pharmaceutical impurity profiling, and environmental monitoring.
Heptafluorobutyranilide structure
Heptafluorobutyranilide structure
Product Name:Heptafluorobutyranilide
CAS No:336-61-8
MF:C10H6F7NO
MW:289.149567127228
CID:307902
PubChem ID:9556
Update Time:2025-05-27

Heptafluorobutyranilide Chemical and Physical Properties

Names and Identifiers

    • Butanamide,2,2,3,3,4,4,4-heptafluoro-N-phenyl-
    • Heptafluorobutyranilide
    • 2,2,3,3,4,4,4-heptafluoro-N-phenylbutanamide
    • 2,2,3,3,4,4,4-heptafluorobutyranilide
    • 2,2,3,3,4,4,4-HEPTAFLUORO-N-PHENYL-BUTANAMIDE
    • Heptafluor-buttersaeure-anilid
    • Heptafluor-butyranilid
    • heptafluoro-butyric acid anilide
    • NSC404378
    • Butyranilide,.alpha.,.beta.,.beta.,.gamma.,.gamma.,.gamma.-heptafluoro-
    • Aniline, N-heptafluorobutyryl-
    • Butyranilide, 2,2,3,3,4,4,4-heptafluoro-
    • NSC-404378
    • Butanamide,2,3,3,4,4,4-heptafluoro-N-phenyl-
    • AI3-18011
    • Butyranilide,2,3,3,4,4,4-heptafluoro-
    • DTXSID50187299
    • FT-0669119
    • starbld0007507
    • alpha,alpha,beta,beta,gamma,gamma,gamma-Heptafluorobutyranilide
    • BRN 2751596
    • BUTYRANILIDE, alpha,alpha,beta,beta,gamma,gamma,gamma-HEPTAFLUORO-
    • SCHEMBL8846991
    • AI 3-18011
    • WLN: FXFFXFFXFFVMR
    • UNII-FH26UK9AJK
    • J-019287
    • 4-12-00-00388 (Beilstein Handbook Reference)
    • 336-61-8
    • AKOS003625974
    • NSC 404378
    • Butanamide, 2,2,3,3,4,4,4-heptafluoro-N-phenyl- (9CI)
    • NS00110522
    • Butanamide, 2,2,3,3,4,4,4-heptafluoro-N-phenyl-
    • Butyranilide, .alpha.,.alpha.,.beta.,.beta.,.gamma.,.gamma.,.gamma.-heptafluoro-
    • FH26UK9AJK
    • DB-230507
    • Inchi: 1S/C10H6F7NO/c11-8(12,9(13,14)10(15,16)17)7(19)18-6-4-2-1-3-5-6/h1-5H,(H,18,19)
    • InChI Key: AFGARRAOIQHNDW-UHFFFAOYSA-N
    • SMILES: FC(C(NC1C=CC=CC=1)=O)(C(C(F)(F)F)(F)F)F

Computed Properties

  • Exact Mass: 289.03400
  • Monoisotopic Mass: 289.03376095g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 3
  • Complexity: 333
  • 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: 3.6
  • Topological Polar Surface Area: 29.1?2

Experimental Properties

  • Density: 1.491
  • Boiling Point: 257.9°Cat760mmHg
  • Flash Point: 109.8°C
  • Refractive Index: 1.437
  • PSA: 29.10000
  • LogP: 3.53100

Heptafluorobutyranilide Customs Data

  • HS CODE:2924299090
  • Customs Data:

    China Customs Code:

    2924299090

    Overview:

    2924299090. Other cyclic amides(Including cyclic carbamates)(Including their derivatives as well as their salts). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, packing

    Summary:

    2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Heptafluorobutyranilide Pricemore >>

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