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68774-79-8

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Basic Information
CAS No.: 68774-79-8
Name: 8-AMINO-1,2,4-TRIAZOLO[4,3-A]PYRAZINE
Molecular Structure:
Molecular Structure of 68774-79-8 (8-AMINO-1,2,4-TRIAZOLO[4,3-A]PYRAZINE)
Formula: C5H5N5
Molecular Weight: 135.128
Synonyms: NSC 294775;8-Amino-1,2,4-triazolo[4,3-a]pyrazine;
Density: 1.74 g/cm3
PSA: 69.10000
LogP: 0.28770
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Specification

The 1,2,4-Triazolo[4,3-a]pyrazin-8-amine, with the CAS registry number 68774-79-8, is also known as 8-Amino-1,2,4-triazolo[4,3-a]pyrazine. This chemical's molecular formula is C5H5N5 and molecular weight is 135.13. What's more, its systematic name is [1,2,4]Triazolo[4,3-a]pyrazin-8-amine.

Physical properties of 1,2,4-Triazolo[4,3-a]pyrazin-8-amine are: (1)ACD/LogP: -0.92; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 46.32 Å2; (7)Index of Refraction: 1.88; (8)Molar Refractivity: 35.51 cm3; (9)Molar Volume: 77.5 cm3; (10)Polarizability: 14.08×10-24 cm3; (11)Surface Tension: 89.3 dyne/cm; (12)Density: 1.74 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: n2ccn1c(nnc1)c2N
(2)InChI: InChI=1/C5H5N5/c6-4-5-9-8-3-10(5)2-1-7-4/h1-3H,(H2,6,7)
(3)InChIKey: RDUBUZQXHRTBOB-UHFFFAOYAT