Basic information
- Standard SMILES
N#COc1ccc(C2(c3ccc(O)cc3)CCCCC2)cc1- InChIKey
GPZXMAFOEVKKSW-UHFFFAOYSA-N- Molecular formula
- C19H19NO2
- Average molar mass
- 293.4 g/mol
Names & identifiers
- Preferred name
- 1-(4-Hydroxyphenyl)-1-(4-cyanatophenyl)-cyclohexane
- IUPAC
- [4-[1-(4-hydroxyphenyl)cyclohexyl]phenyl] cyanate
Names & synonyms
SCHEMBL11707078GPZXMAFOEVKKSW-UHFFFAOYSA-N1-(4-hydroxyphenyl)-1-(4-cyanatophenyl)-cyclohexane
Database identifiers
- PubChem CID
- 21395867
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 53.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 391
Related reactions
2 records
Linked notes
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