Cas no 1185162-28-0 (5-Amino-1-tert-butyl-3-(3-methylbenzyl)-4-cyanopyrazole)

5-Amino-1-tert-butyl-3-(3-methylbenzyl)-4-cyanopyrazole structure
1185162-28-0 structure
Product Name:5-Amino-1-tert-butyl-3-(3-methylbenzyl)-4-cyanopyrazole
CAS No:1185162-28-0
MF:C16H20N4
MW:268.356802940369
CID:1065271
PubChem ID:29971389
Update Time:2025-04-20

5-Amino-1-tert-butyl-3-(3-methylbenzyl)-4-cyanopyrazole Chemical and Physical Properties

Names and Identifiers

    • 5-Amino-1-tert-butyl-3-(3-methylbenzyl)-4-cyanopyrazole
    • 5-amino-1-tert-butyl-3-[(3-methylphenyl)methyl]pyrazole-4-carbonitrile
    • 1185162-28-0
    • DTXSID80652425
    • DB-295967
    • 5-Amino-1-tert-butyl-3-[(3-methylphenyl)methyl]-1H-pyrazole-4-carbonitrile
    • Inchi： 1S/C16H20N4/c1-11-6-5-7-12(8-11)9-14-13(10-17)15(18)20(19-14)16(2,3)4/h5-8H,9,18H2,1-4H3
    • InChI Key： QMVSXFKVXNGFAZ-UHFFFAOYSA-N
    • SMILES： N1(C(=C(C#N)C(CC2C=CC=C(C)C=2)=N1)N)C(C)(C)C

Computed Properties

  • Exact Mass: 268.16879665g/mol
  • Monoisotopic Mass: 268.16879665g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 3
  • Complexity: 378
  • 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: 3.4
  • Topological Polar Surface Area: 67.6?2

Experimental Properties

  • Density: 1.1±0.1 g/cm3
  • Boiling Point: 444.3±45.0 °C at 760 mmHg
  • Flash Point: 222.5±28.7 °C
  • Vapor Pressure: 0.0±1.1 mmHg at 25°C

5-Amino-1-tert-butyl-3-(3-methylbenzyl)-4-cyanopyrazole Security Information

5-Amino-1-tert-butyl-3-(3-methylbenzyl)-4-cyanopyrazole Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
A602950-20mg
5-Amino-1-tert-butyl-3-(3-methylbenzyl)-4-cyanopyrazole
 1185162-28-0
20mg
 $ 161.00 2023-09-08
TRC
A602950-200mg
5-Amino-1-tert-butyl-3-(3-methylbenzyl)-4-cyanopyrazole
 1185162-28-0
200mg
 $ 1206.00 2023-09-08

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