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4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile

4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile structure

CAS No:
915707-41-4
Formula:
C11H9N3
Chemical Name:
4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile
Synonyms:
4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile;4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile 97%;4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile97%;Benzonitrile, 4-(1-methyl-1H-pyrazol-3-yl)-

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4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile Basic Attributes

Molecular Weight：

183.21

Exact Mass：

183.079647300

DSSTox ID：

DTXSID30640190

HScode：

2933199090

Characteristics

PSA：

41.61000

XLogP3：

1.95878

Density：

1.11±0.1 g/cm3

Melting Point：

146 °C

Boiling Point：

356.4±25.0 °C(Predicted)

Flash Point：

169.4ºC

Refractive Index：

1.61

PKA：

0.80±0.10

Computed Properties

Molecular Weight:183.21
XLogP3:1.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:183.079647300
Monoisotopic Mass:183.079647300
Topological Polar Surface Area:41.6
Heavy Atom Count:14
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile

Basic Attributes
Characteristics
Computed Properties

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