6-Decyloxynaphthalene-2-carbonitrile
Basic information
- CAS
66217-28-5- Standard SMILES
CCCCCCCCCCOc1ccc2cc(C#N)ccc2c1- InChIKey
VIHSPNBFGOOLRU-UHFFFAOYSA-N- Molecular formula
- C21H27NO
- Average molar mass
- 309.4 g/mol
- Monoisotopic mass
- 309.20926449
Names & identifiers
- Preferred name
- 6-Decyloxynaphthalene-2-carbonitrile
- IUPAC
- 6-decoxynaphthalene-2-carbonitrile
Names & synonyms
6-Decyloxynaphthalene-2-carbonitrile66217-28-52-Naphthalenecarbonitrile, 6-(decyloxy)-DTXSID10344568VIHSPNBFGOOLRU-UHFFFAOYSA-N6-(Decyloxy)-2-naphthonitrile #6-Decyloxy-naphthalene-2-carbonitrile6-(DECYLOXY)NAPHTHALENE-2-CARBONITRILE
Database identifiers
- CAS
66217-28-5- PubChem CID
- 597941
- DTXSID
DTXSID10344568
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 33 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 358
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical structure
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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