2,2'-(Prop-2-en-1-ylimino)diacetonitrile
Basic information
- CAS
16969-23-6- Standard SMILES
C=CCN(CC#N)CC#N- InChIKey
ZVJOYOMFDBLYNG-UHFFFAOYSA-N- Molecular formula
- C7H9N3
- Average molar mass
- 135.17 g/mol
- Monoisotopic mass
- 135.0796473
Names & identifiers
- Preferred name
- 2,2'-(Prop-2-en-1-ylimino)diacetonitrile
- IUPAC
- 2-[cyanomethyl(prop-2-enyl)amino]acetonitrile
Names & synonyms
2,2'-(prop-2-en-1-ylimino)diacetonitrile16969-23-6DTXSID80293216RefChem:242130DTXCID50244356NSC87856NCIOpen2_000982NSC-878562,2'-[(Prop-2-en-1-yl)azanediyl]diacetonitrile
Database identifiers
- CAS
16969-23-6- PubChem CID
- 258646
- DTXSID
DTXSID80293216
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 171
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Compound notes
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