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2-(1H-PYRAZOL-1-YL)BENZONITRILE

2-(1H-PYRAZOL-1-YL)BENZONITRILE structure

CAS No:
25775-03-5
Formula:
C10H7N3
Chemical Name:
2-(1H-PYRAZOL-1-YL)BENZONITRILE
Synonyms:
2-(1H-PYRAZOL-1-YL)BENZONITRILE;2-(1H-Pyrazol-1-yl)benzonitrile 97%;2-(1-Pyrazolyl)benzonitrile;Benzonitrile, 2-(1H-pyrazol-1-yl)-

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2-(1H-PYRAZOL-1-YL)BENZONITRILE Basic Attributes

Molecular Weight：

169.18

Exact Mass：

169.063997236

DSSTox ID：

DTXSID70428171

HScode：

2933199090

Characteristics

PSA：

41.61000

XLogP3：

1.74398

Density：

1.13±0.1 g/cm3

Boiling Point：

332.6±25.0 °C(Predicted)

Flash Point：

155ºC

Refractive Index：

1.622

Vapor Pressure：

0.000144mmHg at 25°C

PKA：

-0.51±0.10

Safety Information

Marks：

Computed Properties

Molecular Weight:169.18
XLogP3:1.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:169.063997236
Monoisotopic Mass:169.063997236
Topological Polar Surface Area:41.6
Heavy Atom Count:13
Complexity:218
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1H-PYRAZOL-1-YL)BENZONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

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