2,4,6-Tris[(cyclohexylamino)methyl]phenol
Basic information
- CAS
6642-18-8- Standard SMILES
Oc1c(CNC2CCCCC2)cc(CNC2CCCCC2)cc1CNC1CCCCC1- InChIKey
NDPKKBMWWCJNAR-UHFFFAOYSA-N- Molecular formula
- C27H45N3O
- Average molar mass
- 427.7 g/mol
- Monoisotopic mass
- 427.35626307
Names & identifiers
- Preferred name
- 2,4,6-Tris[(cyclohexylamino)methyl]phenol
- IUPAC
- 2,4,6-tris[(cyclohexylamino)methyl]phenol
Names & synonyms
6642-18-82,4,6-tris[(cyclohexylamino)methyl]phenolNSC47948DTXSID40286841NSC-47948
Database identifiers
- CAS
6642-18-8- PubChem CID
- 240965
- DTXSID
DTXSID40286841
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 56.3 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 451
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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