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4-(2-methylprop-2-enyl)benzonitrile

4-(2-methylprop-2-enyl)benzonitrile structure

CAS No:
97780-97-7
Formula:
C11H11N
Chemical Name:
4-(2-methylprop-2-enyl)benzonitrile
Synonyms:
4-(2-methyl-prop-2-enyl)-benzonitrile; 4-(2-methylallyl)benzonitrile; 3-(4-CYANOPHENYL)-2-METHYL-1-PROPENE; Benzonitrile,4-(2-methyl-2-propenyl); 4-(2-methyl-2-propenyl)benzonitrile;

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4-(2-methylprop-2-enyl)benzonitrile Basic Attributes

Molecular Weight：

157.21200

Exact Mass：

157.089149355

DSSTox ID：

DTXSID00539946

HScode：

2926909090

Characteristics

PSA：

23.79000

XLogP3：

2.67688

Density：

0.97g/cm3

Boiling Point：

261.6ºC

Flash Point：

112.1ºC

Refractive Index：

1.526

Computed Properties

Molecular Weight:157.21
XLogP3:3.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:157.089149355
Monoisotopic Mass:157.089149355
Topological Polar Surface Area:23.8
Heavy Atom Count:12
Complexity:200
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(2-methylprop-2-enyl)benzonitrile

Basic Attributes
Characteristics
Computed Properties

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