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175205-09-1

175205-09-1 Structure

175205-09-1 Structure
IdentificationMore
[Name]

5-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]TETRAZOLE
[CAS]

175205-09-1
[Synonyms]

KG-548
Activator 42
KG-548 (KG548)
BUTTPARK 1\01-72
Activator 42(R) 0.1 M
5-[3,5-Bis(trifluoromethyl)phenyl]-1H-tetra
5-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]TETRAZOLE
5-[3,5-Bis(trifluoromethyl)phenyl]tetrazole97%
5-[3,5-Bis(trifluoromethyl)phenyl]-1H-tetrazole
5-[3,5-bis(trifluoromethyl)phenyl]-2H-tetrazole
5-[3,5-Bis(trifluoromethyl)phenyl]tetrazole 97%
2H-Tetrazole, 5-[3,5-bis(trifluoromethyl)phenyl]-
5-[3,5-Bis(trifluoromethyl)phenyl]-1H-tetrazole 97%
5-[3,5-DI(TRIFLUOROMETHYL)PHENYL]-2H-1,2,3,4-TETRAAZOLE
5-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]-2H-1,2,3,4-TETRAZOLE
[Molecular Formula]

C9H4F6N4
[MDL Number]

MFCD00052524
[Molecular Weight]

282.15
[MOL File]

175205-09-1.mol
Chemical PropertiesBack Directory
[Melting point ]

177-180°C
[Boiling point ]

298.2±50.0 °C(Predicted)
[density ]

1.569±0.06 g/cm3(Predicted)
[Fp ]

5℃
[storage temp. ]

Sealed in dry,2-8°C
[solubility ]

DMSO: soluble20mg/mL, clear
[form ]

powder
[pka]

3.59±0.10(Predicted)
[color ]

white to beige
[InChI]

1S/C9H4F6N4/c10-8(11,12)5-1-4(7-16-18-19-17-7)2-6(3-5)9(13,14)15/h1-3H,(H,16,17,18,19)
[InChIKey]

KKJFZIQEWZVVIV-UHFFFAOYSA-N
[SMILES]

FC(F)(F)c1cc(cc(c1)c2n[nH]nn2)C(F)(F)F
[CAS DataBase Reference]

175205-09-1(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

25-36/37/38
[Safety Statements ]

26-45
[RIDADR ]

UN 2811 6.1 / PGIII
[WGK Germany ]

3
[Hazard Note ]

Irritant
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Flam. Liq. 2
Skin Irrit. 2
Hazard InformationBack Directory
[Uses]

KG-548 is an ARNT/TACC3 disruptor and a HIF-1α inhibitor. KG-548 directly interferes with ARNT/TACC3 complex formation by competing with TACC3 for binding to the ARNT PAS-B domain. ARNT is the aryl hydrocarbon receptor nuclear translocator, also known as HIF-β[1][2].
[References]

[1] Guo Y, et al. Regulating the ARNT/TACC3 axis: multiple approaches to manipulating protein/protein interactions with small molecules. ACS Chem Biol. 2013 Mar 15;8(3):626-35. DOI:10.1021/cb300604u
[2] Kleszcz R, et al. The inhibition of c-MYC transcription factor modulates the expression of glycolytic and glutaminolytic enzymes in FaDu hypopharyngeal carcinoma cells. Adv Clin Exp Med. 2018 Jun;27(6):735-742. DOI:10.17219/acem/68979
Spectrum DetailBack Directory
[Spectrum Detail]

5-[3,5-BIS(TRIFLUOROMETHYL)PHENYL]TETRAZOLE(175205-09-1)1HNMR
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