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3,5-bis(pyridin-4-yl)-4-amino-1,2,4-triazole

3,5-bis(pyridin-4-yl)-4-amino-1,2,4-triazole structure

CAS No:
38634-05-8
Formula:
C12H10N6
Chemical Name:
3,5-bis(pyridin-4-yl)-4-amino-1,2,4-triazole
Synonyms:
3,5-bis(pyridin-4-yl)-4-amino-1,2,4-triazole;(4-amino-3,5-bis(4-pyridyl)-1,2,4-triazole);Iproniazid Impurity 1;JACS-38634-05-8;4H-1,2,4-Triazol-4-amine, 3,5-di-4-pyridinyl-;Isoniazid Impurity 7;Topiroxostat impurity 4/4-Amino-3,5-bis(4-pyridyl)-1,2,4-triazole
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Specialty Chemicals

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3,5-bis(pyridin-4-yl)-4-amino-1,2,4-triazole Basic Attributes

Molecular Weight：

238.25

Exact Mass：

238.09669434 g/mol

Characteristics

PSA：

82.5 Å²

Density：

1.42±0.1 g/cm3

Melting Point：

335-340 °C (decomp)

Boiling Point：

555.6±60.0 °C(Predicted)

PKA：

2.22±0.10

Computed Properties

Molecular Weight:238.25
XLogP3:0.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:238.09669434
Monoisotopic Mass:238.09669434
Topological Polar Surface Area:82.5
Heavy Atom Count:18
Complexity:235
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 38634-05-8

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Guide of 3,5-bis(pyridin-4-yl)-4-amino-1,2,4-triazole

Basic Attributes
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