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4-(2-Methylpropyl)benzeneacetonitrile

4-(2-Methylpropyl)benzeneacetonitrile structure

CAS No:
40784-95-0
Formula:
C12H15N
Chemical Name:
4-(2-Methylpropyl)benzeneacetonitrile
Synonyms:
Benzeneacetonitrile,4-(2-methylpropyl)-;Acetonitrile,(p-isobutylphenyl)-;4-(2-Methylpropyl)benzeneacetonitrile;4-Isobutylphenylacetonitrile;(p-Isobutylphenyl)acetonitrile;p-Isobutylbenzyl cyanide;4-Isobutylbenzyl cyanide;p-Isobutylbenzeneacetonitrile;2-[4-(2-Methylpropyl)phenyl]acetonitrile

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4-(2-Methylpropyl)benzeneacetonitrile Basic Attributes

Molecular Weight：

173.25 g/mol

Exact Mass：

173.25

EC Number：

255-079-6

DSSTox ID：

DTXSID70193776

Characteristics

PSA：

23.8 Å²

Boiling Point：

100 °C @ Press: 1 Torr

Computed Properties

Molecular Weight:173.25
XLogP3:3.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:173.120449483
Monoisotopic Mass:173.120449483
Topological Polar Surface Area:23.8
Heavy Atom Count:13
Complexity:179
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(2-Methylpropyl)benzeneacetonitrile

Basic Attributes
Characteristics
Computed Properties

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