Basic information
- CAS
6629-87-4- Standard SMILES
N#CC1=C(N)CCC2(C1)c1ccccc1-c1ccccc12- InChIKey
MEWLHKUFRFZVQX-UHFFFAOYSA-N- Molecular formula
- C19H16N2
- Average molar mass
- 272.3 g/mol
- Monoisotopic mass
- 272.13134852
Names & identifiers
- Preferred name
- 4-Aminospiro[cyclohex-3-ene-1,9'-fluorene]-3-carbonitrile
- IUPAC
- 2-aminospiro[cyclohexene-5,9'-fluorene]-1-carbonitrile
Names & synonyms
6629-87-44-Aminospiro[cyclohex[3]ene-1,9'-fluorene]-3-carbonitrile4-aminospiro[cyclohex-3-ene-1,9'-fluorene]-3-carbonitrileNSC60503DTXSID50984846NSC-60503
Database identifiers
- CAS
6629-87-4- PubChem CID
- 246901
- DTXSID
DTXSID50984846
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 487
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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