4-Amino-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarbonitrile supplier

Name
4-amino-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarbonitrile
EINECS
CAS No. 103151-40-2
Article Data3
CAS DataBase
Density 1.31 g/cm³
Solubility
Melting Point 189℃
Formula C₁₀H₁₄N₆
Boiling Point 457.4 °C at 760 mmHg
Molecular Weight 218.261
Flash Point 230.5 °C
Transport Information
Appearance
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Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-amino-2-(4-methyl-piperazin-1-yl)-pyrimidine-5-carbonitrile;4-amino-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarbonitrile;HMS1439P05;4-Amino-2-(N'-methyl-piperazino)-5-cyan-pyrimidin;
PSA 82.80000
LogP -0.38472

4-Amino-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarbonitrile Specification

This chemical is called 4-Amino-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarbonitrile. With the molecular formula of C₁₀H₁₄N₆, its molecular weight is 218.26. The CAS registry number of this chemical is 103151-40-2.

Other characteristics of the 4-Amino-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarbonitrile can be summarised as followings: (1)ACD/LogP: 0.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.7; (4)ACD/LogD (pH 7.4): 2.01; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 18.94; (7)ACD/KOC (pH 5.5): 13.1; (8)ACD/KOC (pH 7.4): 268.24; (9)#H bond acceptors: 6; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 59.29 Å²; (13)Index of Refraction: 1.637; (14)Molar Refractivity: 59.4 cm³; (15)Molar Volume: 165.4 cm³; (16)Polarizability: 23.54×10^-24cm³; (17)Surface Tension: 79.3 dyne/cm; (18)Density: 1.31 g/cm³; (19)Flash Point: 230.5 °C; (20)Enthalpy of Vaporization: 71.76 kJ/mol; (21)Boiling Point: 457.4 °C at 760 mmHg; (22)Vapour Pressure: 1.49E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: N#Cc1c(nc(nc1)N2CCN(C)CC2)N
2.InChI: InChI=1/C10H14N6/c1-15-2-4-16(5-3-15)10-13-7-8(6-11)9(12)14-10/h7H,2-5H2,1H3,(H2,12,13,14)
3.InChIKey: JVINSPXXPZUMTH-UHFFFAOYAF

Product Name

4-amino-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarbonitrile

4-Amino-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarbonitrile Specification

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