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Home > Encyclopedia > 1-(4-Nitrophenyl)azepane

1-(4-Nitrophenyl)azepane

1-(4-Nitrophenyl)azepane structure

1-(4-Nitrophenyl)azepane 

structure
  • CAS No:

    13663-23-5

  • Formula:

    C12H16N2O2

  • Chemical Name:

    1-(4-Nitrophenyl)azepane

  • Synonyms:

    1H-Azepine,hexahydro-1-(4-nitrophenyl)-;1H-Azepine,hexahydro-1-(p-nitrophenyl)-;Hexamethylenimine,1-(p-nitrophenyl)-;Hexahydro-1-(4-nitrophenyl)-1H-azepine;1-(4-Nitrophenyl)azepane;1-(4-Nitrophenyl)-perhydroazepin

1-(4-Nitrophenyl)azepane Basic Attributes

220.26800

220.27

237-144-0

DTXSID9065574

2933990090

Characteristics

49.06000

3.56340

1.151g/cm3

74-76 °C @ Solvent: Methanol

377.4ºC

182.1ºC

1.564

6.76E-06mmHg at 25°C

1-(4-Nitrophenyl)azepane Use and Manufacturing

1H-Azepine, hexahydro-1-(4-nitrophenyl)-: INACTIVE

Computed Properties

Molecular Weight:220.27
XLogP3:3.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:220.121177757
Monoisotopic Mass:220.121177757
Topological Polar Surface Area:49.1
Heavy Atom Count:16
Complexity:224
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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