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3-Pyridinamine,6-(4-methyl-1-piperazinyl)-

  • Name 3-Pyridinamine,6-(4-methyl-1-piperazinyl)-
  • EINECS200-258-5
  • CAS No. 55403-35-5
  • Density1.142 g/cm3
  • PSA45.39000
  • LogP0.99970
  • SolubilityN/A
  • Melting Point106-108 °C
  • FormulaC10H16N4
  • Boiling Point388.7 °C at 760 mmHg
  • Molecular Weight192.264
  • Flash Point188.9 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 55403-35-5 (3-Amino-6-(4-methylpiperazin-1-yl)pyridine)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data20

3-Pyridinamine,6-(4-methyl-1-piperazinyl)- Specification

The 3-Pyridinamine,6-(4-methyl-1-piperazinyl)-, with the CAS registry number 55403-35-5, is also known as 3-Amino-6-(4-methylpiperazin-1-yl)pyridine. It belongs to the product categories of Amines and Anilines; Heterocycles; Pharmacetical. This chemical's molecular formula is C10H16N4 and molecular weight is 192.2608. What's more, its systematic name is called 6-(4-Methylpiperazin-1-yl)pyridin-3-amine.

Physical properties about 3-Pyridinamine,6-(4-methyl-1-piperazinyl)- are: (1)ACD/LogP: 0.14; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.76; (4)ACD/LogD (pH 7.4): -0.65; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 4.65; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 22.61 Å2; (13)Index of Refraction: 1.593; (14)Molar Refractivity: 57.05 cm3; (15)Molar Volume: 168.2 cm3; (16)Polarizability: 22.62×10-24 cm3; (17)Surface Tension: 51.4 dyne/cm; (18)Density: 1.142 g/cm3; (19)Flash Point: 188.9 °C; (20)Enthalpy of Vaporization: 63.8 kJ/mol; (21)Boiling Point: 388.7 °C at 760 mmHg; (22)Vapour Pressure: 3E-06 mmHg at 25 °C; (23)Melting Point: 106-108 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: n2c(N1CCN(C)CC1)ccc(N)c2
(2) InChI: InChI=1/C10H16N4/c1-13-4-6-14(7-5-13)10-3-2-9(11)8-12-10/h2-3,8H,4-7,11H2,1H3
(3) InChIKey: NZTCEWZBMOTKCJ-UHFFFAOYAO

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