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3-(2-methylpyrazol-3-yl)benzonitrile

3-(2-methylpyrazol-3-yl)benzonitrile structure

CAS No:
179055-95-9
Formula:
C11H9N3
Chemical Name:
3-(2-methylpyrazol-3-yl)benzonitrile
Synonyms:
3-(1-Methyl-1H-pyrazol-5-yl)benzonitrile; 3-(1-methylpyrazol-5-yl)benzonitrile; 3-(2-methyl-2H-pyrazol-3-yl)benzonitrile;

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3-(2-methylpyrazol-3-yl)benzonitrile Basic Attributes

Molecular Weight：

183.20900

Exact Mass：

183.079647300

DSSTox ID：

DTXSID00441010

HScode：

2933199090

Characteristics

PSA：

41.61000

XLogP3：

1.95878

Density：

1.11g/cm3

Melting Point：

96ºC

Boiling Point：

349.9ºC

Flash Point：

165.4ºC

Refractive Index：

1.61

Vapor Pressure：

0mmHg at 25°C

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:242
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(2-methylpyrazol-3-yl)benzonitrile

Basic Attributes
Characteristics
Computed Properties

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