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3-but-3-enylbenzonitrile

3-but-3-enylbenzonitrile structure

CAS No:
161637-21-4
Formula:
C11H11N
Chemical Name:
3-but-3-enylbenzonitrile
Synonyms:
4-(3-cyanophenyl)-butylene; 4-(3-CYANOPHENYL)-1-BUTENE;

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3-but-3-enylbenzonitrile Basic Attributes

Molecular Weight：

157.21200

Exact Mass：

157.089149355

DSSTox ID：

DTXSID20641136

HScode：

2926909090

Characteristics

PSA：

23.79000

XLogP3：

2.67688

Density：

0.97g/cm3

Boiling Point：

249.2ºC

Flash Point：

104.5ºC

Refractive Index：

1.528

Vapor Pressure：

0.0233mmHg at 25°C

Computed Properties

Molecular Weight:157.21
XLogP3:3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:157.089149355
Monoisotopic Mass:157.089149355
Topological Polar Surface Area:23.8
Heavy Atom Count:12
Complexity:186
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-but-3-enylbenzonitrile

Basic Attributes
Characteristics
Computed Properties

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