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2-(3-nitrophenyl)-2H-1,2,3-triazole

2-(3-nitrophenyl)-2H-1,2,3-triazole structure

CAS No:
342623-98-7
Formula:
C8H6N4O2
Chemical Name:
2-(3-nitrophenyl)-2H-1,2,3-triazole
Synonyms:
2-(3-nitrophenyl)-2H-1,2,3-triazole;2H-1,2,3-Triazole, 2-(3-nitrophenyl)-

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2-(3-nitrophenyl)-2H-1,2,3-triazole Basic Attributes

Molecular Weight：

190.16

Exact Mass：

190.04907545

DSSTox ID：

DTXSID40499196

HScode：

2933990090

Characteristics

PSA：

76.53000

XLogP3：

1.69870

Density：

1.46±0.1 g/cm3

Melting Point：

126-127 °C

Boiling Point：

371.3±44.0 °C(Predicted)

PKA：

-0.31±0.22

Computed Properties

Molecular Weight:190.16
XLogP3:1.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:190.04907545
Monoisotopic Mass:190.04907545
Topological Polar Surface Area:76.5
Heavy Atom Count:14
Complexity:212
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(3-nitrophenyl)-2H-1,2,3-triazole

Basic Attributes
Characteristics
Computed Properties

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