Bis(2-cyanoethyl) ether

C6H8N2OCAS 1656-48-0124.14 g/mol

Open in Covalent MOL file
NON
EtherNitrile

Properties

Molecular formula
C6H8N2O
Molar mass
124.14 g/mol
Exact mass
124.0637 Da
Density
1.0482 g/mL (at 25 °C)
Melting point
50 °C
Boiling point
161–162 °C (at 5 Torr)
logP
0.83Crippen estimate
Polar surface area
56.8 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
4

Hazards

Warning
Irritant (GHS07)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P305+P351+P338, P337+P317

Identifiers

CAS number
1656-48-0
SMILES
N#CCCOCCC#N
InChIKey
BCGCCTGNWPKXJL-UHFFFAOYSA-N
InChI
InChI=1S/C6H8N2O/c7-3-1-5-9-6-2-4-8/h1-2,5-6H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

13 names · show all
  • Propanenitrile, 3,3′-oxybis-
  • Propionitrile, 3,3′-oxydi-
  • 3,3′-Oxybis[propanenitrile]
  • β,β′-Dicyanodiethyl ether
  • β,β′-Oxydipropionitrile
  • 3,3′-Oxydipropionitrile
  • β,β′-Bis(cyanoethyl) ether
  • Bis(β-cyanoethyl) ether
  • Bis(propionitrile) ether
  • 3,3′-Oxybispropionitrile
  • 2,2′-Dicyanodiethyl ether
  • NSC 7769
  • 2-Cyanoethyl ether

Work with Bis(2-cyanoethyl) ether

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3-Ethoxypropanenitrile2141-62-065 % similar 3-Butoxypropanenitrile6959-71-364 % similar 3,3′,3′′-[1,2,3-Propanetriyltris(oxy)]tris[propanenitrile]2465-93-257 % similar 3-Methoxypropionitrile110-67-855 % similar 4-Morpholinepropanenitrile4542-47-655 % similar Succinonitrile110-61-253 % similar Adiponitrile111-69-347 % similar Glutaronitrile544-13-847 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-5-methoxypyridine10167-97-2 2-Amino-4-methoxypyridine10201-73-7 (2-Aminopyridin-4-yl)methanol105250-17-7 2-Hydroxy-4,6-dimethylpyrimidine108-79-2 (6-Amino-3-pyridinyl)methanol113293-71-3 4-Aminopyridine-3-methanol138116-34-4 2-Amino-6-methoxypyridine17920-35-3 2-Methoxy-3-pyridinamine20265-38-7

Elsewhere

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