Basic information
- Standard SMILES
CC(C)(C)[Si](C)(C)OCCCCCOc1cccc([N+](=O)[O-])c1C#N- InChIKey
INUHFRRVRUXSHK-UHFFFAOYSA-N- Molecular formula
- C18H28N2O4Si
- Average molar mass
- 364.5 g/mol
- Monoisotopic mass
- 364.18183391
Names & identifiers
- Preferred name
- 2-(5-(Tert-butyldimethylsilyloxy)pentyloxy)-6-nitrobenzonitrile
- IUPAC
- 2-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-6-nitrobenzonitrile
Names & synonyms
SCHEMBL618812INUHFRRVRUXSHK-UHFFFAOYSA-N2-(5-(tert-butyldimethylsilyloxy)pentyloxy)-6-nitrobenzonitrile
Database identifiers
- PubChem CID
- 66745895
Properties
Computed structural properties
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 476
Related reactions
3 records
Compound notes
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