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59944-75-1

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Basic Information
CAS No.: 59944-75-1
Name: Thieno[2,3-b]pyrazin-7-amine
Molecular Structure:
Molecular Structure of 59944-75-1 (Thieno[2,3-b]pyrazin-7-amine)
Formula: C6H5N3S
Molecular Weight: 151.192
Synonyms: Thieno[2,3-b]pyrazin-7-amine 95 %;
Density: 1.486 g/cm3
Melting Point: 88 °C
Boiling Point: 341.631 °C at 760 mmHg
Flash Point: 160.413 °C
Hazard Symbols: IrritantXi
PSA: 80.04000
LogP: 1.85470
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Specification

The Thieno[2, 3-b]pyrazin-7-amine, with the CAS registry number of 59944-75-1, is also known Thieno[2, 3-b]pyrazin-7-amine 95 %. This chemical's molecular formula is C6H5N3S and molecular weight is 151.19.

Physical properties about Thieno[2, 3-b]pyrazin-7-amine are: (1)ACD/LogP: 0.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 25; (6)ACD/BCF (pH 7.4): 25; (7)ACD/KOC (pH 5.5): 346; (8)ACD/KOC (pH 7.4): 346; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 80.04 Å2; (13)Index of Refraction: 1.785; (14)Molar Refractivity: 42.898 cm3; (15)Molar Volume: 101.756 cm3; (16)Surface Tension: 84.369 dyne/cm; (17)Density: 1.486 g/cm3; (18)Flash Point: 160.413 °C; (19)Enthalpy of Vaporization: 58.531 kJ/mol; (20)Boiling Point: 341.631 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Nc2csc1nccnc12
(2) InChI: InChI=1/C6H5N3S/c7-4-3-10-6-5(4)8-1-2-9-6/h1-3H,7H2
(3) InChIKey: ZRVKSPNBHZCQKY-UHFFFAOYAP