Basic information
- CAS
339363-88-1- Standard SMILES
C/C(C#N)=C\N1CCCC1- InChIKey
XKAYNXMZBYIECI-BQYQJAHWSA-N- Molecular formula
- C8H12N2
- Average molar mass
- 136.19 g/mol
- Monoisotopic mass
- 136.10004839
Names & identifiers
- Preferred name
- (E)-2-methyl-3-pyrrolidin-1-ylprop-2-enenitrile
- IUPAC
- (E)-2-methyl-3-pyrrolidin-1-ylprop-2-enenitrile
- English name
- 2-Propenenitrile,2-methyl-3-(1-pyrrolidinyl)-(9CI)
- Molecular formula
- C8H12N2
- Molecular weight
- 136.19428
Names & synonyms
2-Propenenitrile,2-methyl-3-(1-pyrrolidinyl)-(9CI)
Database identifiers
- CAS
339363-88-1- PubChem CID
- 12230637
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 179
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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