2,2,8,8-Tetramethylnonanedinitrile
Basic information
- CAS
13945-80-7- Standard SMILES
CC(C)(C#N)CCCCCC(C)(C)C#N- InChIKey
YCVYNODSHCUHLH-UHFFFAOYSA-N- Molecular formula
- C13H22N2
- Average molar mass
- 206.33 g/mol
- Monoisotopic mass
- 206.17829871
Names & identifiers
- Preferred name
- 2,2,8,8-Tetramethylnonanedinitrile
- IUPAC
- 2,2,8,8-tetramethylnonanedinitrile
Names & synonyms
13945-80-72,2,8,8-tetramethylnonanedinitrileNSC99247DTXSID00295010NSC-99247
Database identifiers
- CAS
13945-80-7- PubChem CID
- 264246
- DTXSID
DTXSID00295010
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 252
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Related reactions
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Compound notes
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