1,4-Methanonaphthalene-2-carbonitrile,1,4-dihydro-6-methoxy-
Basic information
- CAS
71906-42-8- Standard SMILES
COc1ccc2c(c1)C1C=C(C#N)C2C1- InChIKey
BITCZDUITBYHAA-UHFFFAOYSA-N- Molecular formula
- C13H11NO
- Average molar mass
- 197.23 g/mol
- Monoisotopic mass
- 197.08406397
Names & identifiers
- Preferred name
- 1,4-Methanonaphthalene-2-carbonitrile,1,4-dihydro-6-methoxy-
- IUPAC
- 4-methoxytricyclo[6.2.1.02,7]undeca-2(7),3,5,9-tetraene-9-carbonitrile
- English name
- 1,4-Methanonaphthalene-2-carbonitrile,1,4-dihydro-6-methoxy-
- Molecular weight
- 0
Names & synonyms
71906-42-81,4-Methanonaphthalene-2-carbonitrile,1,4-dihydro-6-methoxy-DTXSID309926061,4-Methanonaphthalene-2-carbonitrile, 1,4-dihydro-6-methoxy-6-Methoxy-1,4-dihydro-1,4-methanonaphthalene-2-carbonitrile
Database identifiers
- CAS
71906-42-8- PubChem CID
- 144516
- DTXSID
DTXSID30992606
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 33 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 351
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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