Basic information
- CAS
64011-91-2- Standard SMILES
N#CC(C#N)(CN)C1CCC1C(C#N)(C#N)CN- InChIKey
ISKHJQHKQOYVCG-UHFFFAOYSA-N- Molecular formula
- C12H14N6
- Average molar mass
- 242.28 g/mol
- Monoisotopic mass
- 242.12799447
Names & identifiers
- Preferred name
- Cyclobutane, 1,2-bis((2-amino-1,1-dicyano)ethyl)-
- IUPAC
- 2-[2-(2-amino-1,1-dicyanoethyl)cyclobutyl]-2-(aminomethyl)propanedinitrile
- English name
- 1,2-Bis(2-amino-1,1-dicyanoethyl)cyclobutane
- Molecular formula
- C12H14N6
- Molecular weight
- 242.28
Names & synonyms
64011-91-2CYCLOBUTANE, 1,2-BIS((2-AMINO-1,1-DICYANO)ETHYL)-Tetra-beta-cyanoethyl-1,2-bis(aminomethyl) cyclobutaneRefChem:3349021,2-Bis(2-amino-1,1-dicyanoethyl)cyclobutaneDTXSID20981948DB-2910012,2'-(Cyclobutane-1,2-diyl)bis[(aminomethyl)propanedinitrile]1,2-Cyclobutanediacetonitrile, α1,α2-bis(aminomethyl)-α1,α2-dicyano-2-[2-(2-amino-1,1-dicyanoethyl)cyclobutyl]-2-(aminomethyl)propanedinitrile
Database identifiers
- CAS
64011-91-2- PubChem CID
- 46358
- DTXSID
DTXSID20981948- Nikkaji
- J67.759K
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 444
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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