Zpwpaqjadpmgok-uhfffaoysa-
Basic information
- CAS
75985-58-9- Standard SMILES
N#CCCN1CC1C#N- InChIKey
ZPWPAQJADPMGOK-UHFFFAOYSA-N- Molecular formula
- C6H7N3
- Average molar mass
- 121.14 g/mol
Names & identifiers
- Preferred name
- Zpwpaqjadpmgok-uhfffaoysa-
- IUPAC
- 1-(2-cyanoethyl)aziridine-2-carbonitrile
- English name
- 1-Aziridinepropanenitrile,2-cyano-(9CI)
- Molecular formula
- C6H7N3
- Molecular weight
- 121.13988
Names & synonyms
SCHEMBL11145876ZPWPAQJADPMGOK-UHFFFAOYSA-InChI=1/C6H7N3/c7-2-1-3-9-5-6(9)4-8/h6H,1,3,5H21-Aziridinepropanenitrile,2-cyano-(9CI)
Database identifiers
- CAS
75985-58-9
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 191
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Related reactions
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Compound notes
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