ChemicalBook > CAS DataBase List > 1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI)

1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI)

Product Name: 1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI)
CAS No.: 13423-60-4
Chemical Name: 1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI)
Synonyms: 1-phenyl-1,2,4-triazole;1-Phenyl-1H-1,2,4-triazole;1H-1,2,4-Triazole, 1-phenyl-;1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI)
CBNumber: CB41281794
Molecular Formula: C8H7N3
Formula Weight: 145.16
MOL File: 13423-60-4.mol

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1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI) Property

Melting point:: 47 °C
Boiling point:: 268-270 °C
Density: 1.16±0.1 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
pka: 2.32±0.10(Predicted)
Appearance: Colorless to off-white Solid

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Safety

HS Code: 2933998090

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Hazard and Precautionary Statements (GHS)

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N-Bromosuccinimide Price

AK Scientific

Product number: 6173AA
Product name: 1-Phenyl-1H-1,2,4-triazole
Packaging: 250mg
Price: $131
Updated: 2021/12/16

Apolloscientific

Product number: OR962488
Product name: 1-Phenyl-1H-1,2,4-triazole
Purity: 95%
Packaging: 250mg
Price: $150
Updated: 2021/12/16

SynQuest Laboratories

Product number: 3H32-1-HG
Product name: 1-Phenyl-1H-1,2,4-triazole
Purity: 95%
Packaging: 250mg
Price: $240
Updated: 2021/12/16

Apolloscientific

Product number: OR962488
Product name: 1-Phenyl-1H-1,2,4-triazole
Purity: 95%
Packaging: 1g
Price: $370
Updated: 2021/12/16

American Custom Chemicals Corporation

Product number: CHM0984775
Product name: 1-PHENYL-1H-1,2,4-TRIAZOLE
Purity: 95.00%
Packaging: 5MG
Price: $495.3
Updated: 2021/12/16

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1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI) Chemical Properties,Usage,Production

Definition

ChEBI: 1-phenyl-1H-1,2,4-triazole is a member of triazoles.

Synthesis Reference(s)

The Journal of Organic Chemistry, 21, p. 1037, 1956 DOI: 10.1021/jo01115a610

Synthesis

288-88-0

591-50-4

13423-60-4

1. CuI (0.10 g, 0.50 mmol), 1,2,4-triazole (0.69 g, 10 mmol), K3PO4 (4.4 g, 20 mmol), iodobenzene (1.4 mL, 12 mmol), and N,N'-dimethylethylenediamine (0.11 mL, 1.0 mmol) were dissolved in DMF (5 mL) under argon protection. Mixed well and degassed. 2. The reaction mixture was heated and stirred at 110°C for 72 hours. 3. 3. After completion of the reaction, the reaction mixture was filtered through diatomaceous earth and the filter cake was washed with ethyl acetate (AcOEt). 4. The solvent was removed by pressurized distillation to give the crude product. 5. The crude product was purified using silica gel column chromatography with heptane/ethyl acetate (7:3, v/v) as eluent. 6. 1-Phenyl-1H-1,2,4-triazole (2a) was isolated in 96% yield as a yellow powder with a melting point of 48 °C (literature value 28-46 °C). 7. The structure of the product was confirmed by 1H NMR and 13C NMR: 1H NMR (CDCl3, 300 MHz) δ 7.42 (m, 1H), 7.53 (m, 2H), 7.71 (m, 2H), 8.15 (s, 1H), 8.74 (s, 1H); 13C NMR (CDCl3, 75 MHz) δ 120.1 (2CH) , 128.3 (CH), 129.9 (2CH), 137.1 (C), 140.9 (CH), 152.7 (CH).

References

[1] Journal of the American Chemical Society, 2007, vol. 129, # 45, p. 13879 - 13886
[2] Journal of Organic Chemistry, 2007, vol. 72, # 8, p. 2737 - 2743
[3] Bioorganic and Medicinal Chemistry, 2015, vol. 23, # 19, p. 6355 - 6363
[4] RSC Advances, 2014, vol. 4, # 83, p. 44105 - 44116
[5] Journal of Organic Chemistry, 2004, vol. 69, # 17, p. 5578 - 5587

1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI) Preparation Products And Raw materials

Raw materials

Preparation Products

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13423-60-4, 1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI)Related Search:

3-Hydroxy-1-phenyl-1,2,4-triazole 4-(1,2,4-TRIAZOL-1-YL)PHENOL Triazophos 5-METHYL-3-(METHYLTHIO)-1,4-DIPHENYL-1H-1,2,4-TRIAZOLIUM IODIDE METHYL 3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)BENZENECARBOXYLATE N'-(2,4-DICHLOROPHENYL)-2-[(1-PHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ETHANIMIDOHYDRAZIDE 1-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-4-[4-(1-PHENYL-1H-1,2,4-TRIAZOL-5-YL)PHENYL]PIPERAZINE N-(4-FLUOROPHENYL)-3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)BENZENECARBOXAMIDE 3-[(1-PHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]-2-BUTANONE 3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)BENZENECARBOXYLIC ACID 4-[(4-METHOXYBENZYLIDENE)AMINO]-1-(4-METHYLPHENYL)-4H-1,2,4-TRIAZOL-1-IUM METHANESULFONATE 1,4-DIPHENYL-1H-1,2,4-TRIAZOL-4-IUM-3-THIOLATE 3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)-N-[3-(TRIFLUOROMETHYL)PHENYL]BENZENECARBOXAMIDE N-(3-CHLOROPHENYL)-3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)BENZENECARBOXAMIDE N-(2-CHLOROPHENYL)-3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)BENZENECARBOXAMIDE 1,4,5-TRIPHENYL-4H-1,2,4-TRIAZOL-1-IUM-3-THIOLATE 3-NITRO-4-(1H-1,2,4-TRIAZOL-1-YL)BENZENECARBOXAMIDE 3-(BENZYLTHIO)-1,4-DIPHENYL-1H-1,2,4-TRIAZOL-4-IUM CHLORIDE

1H-1,2,4-Triazole,1-phenyl-(6CI,7CI,8CI,9CI)

1-Phenyl-1H-1,2,4-triazole

1H-1,2,4-Triazole, 1-phenyl-

1-phenyl-1,2,4-triazole

13423-60-4

TRIAZOLE