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4-Ethyl-4-formyloctanenitrile

4-Ethyl-4-formyloctanenitrile structure

CAS No:
5338-97-6
Formula:
C11H19NO
Chemical Name:
4-Ethyl-4-formyloctanenitrile
Synonyms:
Octanenitrile,4-ethyl-4-formyl-;Glutaraldehydonitrile,4-butyl-4-ethyl-;Hexanal,2-(2-cyanoethyl)-2-ethyl-;4-Ethyl-4-formyloctanenitrile;2-(β-Cyanoethyl)-2-ethylhexanal;2-Butyl-4-cyano-2-ethylbutanal;NSC 3447;NSC 5675

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4-Ethyl-4-formyloctanenitrile Basic Attributes

Molecular Weight：

181.27 g/mol

Exact Mass：

181.27

EC Number：

610-994-3

NSC Number：

5675|3447

DSSTox ID：

DTXSID50277664

Characteristics

PSA：

40.9 Å²

Density：

0.9269 g/cm³ @ Temp: 25 °C

Boiling Point：

140-142 °C @ Press: 5 Torr

Computed Properties

Molecular Weight:181.27
XLogP3:2.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:181.146664230
Monoisotopic Mass:181.146664230
Topological Polar Surface Area:40.9
Heavy Atom Count:13
Complexity:192
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Ethyl-4-formyloctanenitrile

Basic Attributes
Characteristics
Computed Properties

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