Malononitrile, 4-chloro-3-nitrobenzylidene-, compd. with tributylphosphine
Basic information
- CAS
73747-65-6- Standard SMILES
CCCCP(CCCC)CCCC.N#CC(C#N)=Cc1ccc(Cl)c([N+](=O)[O-])c1- InChIKey
UGISOXYFXUWGSJ-UHFFFAOYSA-N- Molecular formula
- C22H31ClN3O2P
- Average molar mass
- 435.9 g/mol
- Monoisotopic mass
- 435.1842419
Names & identifiers
- Preferred name
- Malononitrile, 4-chloro-3-nitrobenzylidene-, compd. with tributylphosphine
- IUPAC
- 2-[(4-chloro-3-nitrophenyl)methylidene]propanedinitrile;tributylphosphane
Names & synonyms
73747-65-6DTXSID30224090RefChem:351892DTXCID30146581[(4-Chloro-3-nitrophenyl)methylidene]propanedinitrile--tributylphosphane (1/1)
Database identifiers
- CAS
73747-65-6- PubChem CID
- 52382
- DTXSID
DTXSID30224090
Properties
Computed structural properties
- Topological polar surface area
- 93.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 463
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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