Basic information
- CAS
56705-79-4- Standard SMILES
Nc1ccc(Oc2ccccc2C2CCCCC2)cc1- InChIKey
PLVQWNLOOHOANK-UHFFFAOYSA-N- Molecular formula
- C18H21NO
- Average molar mass
- 267.4 g/mol
- Monoisotopic mass
- 267.16231429
Names & identifiers
- Preferred name
- 4-(2-Cyclohexylphenoxy)aniline
- IUPAC
- 4-(2-cyclohexylphenoxy)aniline
- English name
- 4-(2-cyclohexylphenoxy)aniline
- Molecular formula
- C18H21NO
- Molecular weight
- 267.37
Names & synonyms
4-(2-Cyclohexylphenoxy)aniline56705-79-4EINECS 260-348-6SCHEMBL555108DTXSID10205266PLVQWNLOOHOANK-UHFFFAOYSA-NDB-324721NS000335694-(2-Cyclohexylphenoxy)benzenamineBenzenamine, 4-(2-cyclohexylphenoxy)-
Database identifiers
- CAS
56705-79-4- PubChem CID
- 92504
- DTXSID
DTXSID10205266- EC Number
- 260-348-6
- Nikkaji
- J267.093C
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 279
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Boiling point
- 396 · 396.0±35.0 °C(Predicted)
- Density
- 1.098 · 1.098±0.06 g/cm3(Predicted)
- pka
- 4.77 · 4.77±0.10(Predicted)
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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