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Home > Encyclopedia > 3,3-DIMETHYLBUTYRONITRILE

3,3-DIMETHYLBUTYRONITRILE

3,3-DIMETHYLBUTYRONITRILE structure

3,3-DIMETHYLBUTYRONITRILE 

structure
  • CAS No:

    3302-16-7

  • Formula:

    C6H11N

  • Chemical Name:

    3,3-DIMETHYLBUTYRONITRILE

  • Synonyms:

    tert-butylacetonitrile;3,3-dimethylbutanenitrile;3,3-Dimethylbutyronitrile;3,3-Dimethyl-butyronitrile;Butanenitrile, 3,3-dimethyl-;NSC1079;t-butylacetonitrile;Butanenitrile,3-dimethyl-;Butanenitrile,3,3-dimethyl-

3,3-DIMETHYLBUTYRONITRILE Basic Attributes

97.15820

97.08910

1079

DTXSID20277191

2926909090

Characteristics

23.79000

1.94618

0.802g/cm3

33°C

130.5ºC at 760 mmHg

21.4ºC

1.406

Safety Information

P264, P270, P280, P301+P310, P302+P352, P312, P321, P322, P330, P361, P363, P405, P501

H301

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P312, P321, P322, P330, P361, P363, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

tert-butylacetonitrile

Computed Properties

Molecular Weight:97.16
XLogP3:1.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:97.089149355
Monoisotopic Mass:97.089149355
Topological Polar Surface Area:23.8
Heavy Atom Count:7
Complexity:88.5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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