Basic information
- CAS
5766-68-7- Standard SMILES
CN(CC#N)CCN(C)CC#N- InChIKey
XIRHPUATWAYWSH-UHFFFAOYSA-N- Molecular formula
- C8H14N4
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.12184646
Names & identifiers
- Preferred name
- Acetonitrile, (N,N'-dimethylethylenedinitrilo)di-
- IUPAC
- 2-[2-[cyanomethyl(methyl)amino]ethyl-methylamino]acetonitrile
- English name
- Ethylenebis(methylimino)bis(acetonitrile)
- Molecular formula
- C8H14N4
- Molecular weight
- 166.22
Names & synonyms
5766-68-7N,N'-Dicyanomethyl-N,N'-dimethylethylenediamine(N,N'-Dimethylethylenedinitrilo)diacetonitrileACETONITRILE, (N,N'-DIMETHYLETHYLENEDINITRILO)DI-N,N'-Dimethyl-N,N'-dicyanomethylaethylendiamin [German]N,N'-Dimethyl-N,N'-dicyanomethylaethylendiaminDTXSID80206361RefChem:316842DTXCID80128852SCHEMBL75666802,2'-[Ethane-1,2-diylbis(methylazanediyl)]diacetonitrileEthylenebis(methylimino)bis(acetonitrile)
Show more names
N,N'-bis(cyanomethyl)-N,N'-dimethyl-1,2-diaminoethaneAcetonitrile, 2,2'-[1,2-ethanediylbis(methylimino)]bis- (9CI)
Database identifiers
- CAS
5766-68-7- PubChem CID
- 21985
- DTXSID
DTXSID80206361- Nikkaji
- J55.003E
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 54.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 182
Physicochemical properties
- Melting point
- 79 °C · 79 °C
- Boiling point
- 314.6 · 314.6±22.0 °C(Predicted)
- Density
- 1.026 · 1.026±0.06 g/cm3(Predicted)
- pka
- 4.06 · 4.06±0.50(Predicted)
Chemistry & industry
Suppliers1 total
ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD+8613676922317 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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