1,2,4-triphenylbutane-1,4-dione

Modify Date: 2025-08-23 08:23:02

1,2,4-triphenylbutane-1,4-dione Structure
1,2,4-triphenylbutane-1,4-dione structure
Common Name 1,2,4-triphenylbutane-1,4-dione
CAS Number 4441-01-4 Molecular Weight 314.37700
Density 1.143g/cm3 Boiling Point 496.2ºC at 760 mmHg
Molecular Formula C22H18O2 Melting Point 126-127ºC
MSDS N/A Flash Point 183.6ºC

 Names

Name 1,2,4-triphenylbutane-1,4-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.143g/cm3
Boiling Point 496.2ºC at 760 mmHg
Melting Point 126-127ºC
Molecular Formula C22H18O2
Molecular Weight 314.37700
Flash Point 183.6ºC
Exact Mass 314.13100
PSA 34.14000
LogP 4.92610
Index of Refraction 1.607
InChIKey UDJIUKWJBHQMBG-UHFFFAOYSA-N
SMILES O=C(CC(C(=O)c1ccccc1)c1ccccc1)c1ccccc1

 Safety Information

Safety Phrases S22-S24/25
HS Code 2914399090

 Synthetic Route

 Customs

HS Code 2914399090
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-triphenylbutane-1,4-dioneBioassay

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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
Name: Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
Source: Broad Institute
Target: N/A
External Id: 7124-01_Inhibitor_SinglePoint_HTS_Activity
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
Name: uHTS identification of small molecule modulators of NR3A
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1015-NR3A-Primary-Assay
Name: uHTS identification of small molecule modulators of Rev-erb Alpha.
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: SBCCG-A1016-RevErbaLBD-Primary-Assay
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 Synonyms

1.4-Dioxo-1.2.4-triphenyl-butan
MFCD00043773
1,4-Butanedione,1,2,4-triphenyl
1,2,4-Triphenyl-1,4-butanedione
1,2,4-triphenyl-1,4-dione
1,2,4-triphenyl-1,4-butandione
1,2,4-triphenyl-butane-1,4-dione
1,2,4-Triphenyl-butan-1,4-dion
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