Cas no 4441-01-4 (1,2,4-Triphenyl-1,4-butanedione)

1,2,4-Triphenyl-1,4-butanedione structure
4441-01-4 structure
Product Name:1,2,4-Triphenyl-1,4-butanedione
CAS No:4441-01-4
MF:C22H18O2
MW:314.377126216888
CID:85047
PubChem ID:95413
Update Time:2025-04-18

1,2,4-Triphenyl-1,4-butanedione Chemical and Physical Properties

Names and Identifiers

    • 1,2,4-Triphenyl-1,4-butanedione
    • 1,2,4-triphenyl-1,4-butandione
    • 1,2,4-triphenyl-1,4-dione
    • 1,2,4-Triphenyl-butan-1,4-dion
    • 1,2,4-triphenyl-butane-1,4-dione
    • 1,4-Butanedione,1,2,4-triphenyl
    • 1.4-Dioxo-1.2.4-triphenyl-butan
    • NSC 7759
    • AI3-17642
    • 1,2,4-triphenylbutane-1,4-dione
    • 1,4-Butanedione, 1,2,4-triphenyl-
    • 1, 1,2,4-triphenyl-
    • FT-0606257
    • MFCD00043773
    • NSC7759
    • HMS3093K16
    • FT-0606256
    • NSC-7759
    • AKOS015840582
    • SCHEMBL6201780
    • 1,2,4-TRIPHENYLBUTAN-1,4-DIONE
    • ICCB6_000113
    • 4441-01-4
    • MLS002638027
    • Desyl-p-acetophenon
    • CHEMBL1708985
    • SMR001547529
    • DTXSID30884072
    • UDJIUKWJBHQMBG-UHFFFAOYSA-N
    • DB-051215
    • DTXCID901023543
    • MDL: MFCD00043773
    • Inchi: 1S/C22H18O2/c23-21(18-12-6-2-7-13-18)16-20(17-10-4-1-5-11-17)22(24)19-14-8-3-9-15-19/h1-15,20H,16H2
    • InChI Key: UDJIUKWJBHQMBG-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC=CC=1)C(C1C=CC=CC=1)CC(C1C=CC=CC=1)=O
    • BRN: 2056791

Computed Properties

  • Exact Mass: 314.13100
  • Monoisotopic Mass: 314.13068
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 6
  • Complexity: 410
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 4
  • XLogP3: 4.7
  • Topological Polar Surface Area: 34.1

Experimental Properties

  • Color/Form: White solid
  • Density: 1.143
  • Melting Point: 126-127°C
  • Boiling Point: 496.2°C at 760 mmHg
  • Flash Point: 183.6°C
  • Refractive Index: 1.607
  • PSA: 34.14000
  • LogP: 4.92610
  • Solubility: Uncertain
  • Vapor Pressure: 0.0±1.3 mmHg at 25°C

1,2,4-Triphenyl-1,4-butanedione Customs Data

  • HS CODE:2914399090
  • Customs Data:

    China Customs Code:

    2914399090

    Overview:

    2914399090. Other aromatic ketones without other oxygen-containing groups. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:5.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acetone declared packaging

    Summary:

    2914399090. other aromatic ketones without other oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:5.5%. General tariff:30.0%

1,2,4-Triphenyl-1,4-butanedione Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
A2B Chem LLC
AB57025-5g
1,2,4-TRIPHENYL-1,4-BUTANEDIONE
4441-01-4
5g
$107.00 2024-04-20
1PlusChem
1P003DS1-5g
1,2,4-TRIPHENYL-1,4-BUTANEDIONE
4441-01-4
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$114.00 2024-05-02

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