1,2,4-Triazin-5-amine, 3-[(1-methylethyl)thio]- supplier

Name
3-(ISOPROPYLSULFANYL)-1,2,4-TRIAZIN-5-YLAMINE
EINECS
CAS No. 187099-36-1
Density 1.25 g/cm³
Solubility
Melting Point
Formula C₆H₁₀N₄S
Boiling Point 361.3 °C at 760 mmHg
Molecular Weight 170.24
Flash Point 172.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-(ISOPROPYLSULFANYL)-1,2,4-TRIAZIN-5-YLAMINE;5-AMINO-3-[(1-METHYLETHYL)THIO]-1,2,4-TRIAZINE;5-Amino-3-[(1-methylethyl)thio]-1,2,4-triazin
PSA 89.99000
LogP 1.53550

1,2,4-Triazin-5-amine, 3-[(1-methylethyl)thio]- Specification

This chemical is called 1,2,4-Triazin-5-amine, 3-[(1-methylethyl)thio]-, and its systematic name is 3-[(1-methylethyl)sulfanyl]-1,2,4-triazin-5-amine. With the molecular formula of C₆H₁₀N₄S, its molecular weight is 170.24. The CAS registry number of this chemical is 187099-36-1.

Other characteristics of the 1,2,4-Triazin-5-amine, 3-[(1-methylethyl)thio]- can be summarised as followings: (1)ACD/LogP: -0.43; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 13.71; (6)ACD/KOC (pH 7.4): 13.93; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 67.21 Å²; (11)Index of Refraction: 1.585; (12)Molar Refractivity: 45.64 cm³; (13)Molar Volume: 136 cm³; (14)Polarizability: 18.09×10^-24cm³; (15)Surface Tension: 66.7 dyne/cm; (16)Density: 1.25 g/cm³; (17)Flash Point: 172.3 °C; (18)Enthalpy of Vaporization: 60.71 kJ/mol; (19)Boiling Point: 361.3 °C at 760 mmHg; (20)Vapour Pressure: 2.1E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: S(c1nc(N)cnn1)C(C)C
2.InChI: InChI=1/C6H10N4S/c1-4(2)11-6-9-5(7)3-8-10-6/h3-4H,1-2H3,(H2,7,9,10)
3.InChIKey: ZMPTXAHXQNUFOK-UHFFFAOYAJ

Product Name

3-(ISOPROPYLSULFANYL)-1,2,4-TRIAZIN-5-YLAMINE

1,2,4-Triazin-5-amine, 3-[(1-methylethyl)thio]- Specification

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