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Home > Encyclopedia > Hexahydro-1H-azepine-1-butanenitrile

Hexahydro-1H-azepine-1-butanenitrile

Hexahydro-1H-azepine-1-butanenitrile structure

Hexahydro-1H-azepine-1-butanenitrile 

structure
  • CAS No:

    3194-43-2

  • Formula:

    C10H18N2

  • Chemical Name:

    Hexahydro-1H-azepine-1-butanenitrile

  • Synonyms:

    1H-Azepine-1-butanenitrile,hexahydro-;1H-Azepine-1-butyronitrile,hexahydro-;Hexahydro-1H-azepine-1-butanenitrile;NSC 165580

Hexahydro-1H-azepine-1-butanenitrile Basic Attributes

166.26300

166.26

221-694-3

V9AX471ZUG

165580

DTXSID00185780

2933990090

Characteristics

27.03000

2.10408

0.927g/cm3

287.6ºC at 760mmHg

117.7ºC

1.467

Safety Information

UN 3276

20/21/22-36/38

26-36/37/39

P264, P270, P301+P310, P321, P330, P405, P501

H301

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:166.26
XLogP3:1.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:166.146998583
Monoisotopic Mass:166.146998583
Topological Polar Surface Area:27
Heavy Atom Count:12
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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