Basic information
- CAS
32857-07-1- Standard SMILES
CN(C)Cc1cc(C(C)(C)C)cc(C(C)(C)C)c1O- InChIKey
HKFRBBJLBRGTLM-UHFFFAOYSA-N- Molecular formula
- C17H29NO
- Average molar mass
- 263.4 g/mol
- Monoisotopic mass
- 263.22491455
Names & identifiers
- Preferred name
- 2,4-Di-tert-butyl-6-dimethylaminomethyl-phenol
- IUPAC
- 2,4-ditert-butyl-6-[(dimethylamino)methyl]phenol
Names & synonyms
32857-07-12,4-Di-tert-butyl-6-dimethylaminomethyl-phenolDTXSID80279535RefChem:246075DTXCID602306892,4-di-tert-butyl-6-[(dimethylamino)methyl]phenol2,4-DI-TERT-BUTYL-6-((DIMETHYLAMINO)METHYL)PHENOL2-(dimethylaminomethyl)-4,6-ditert-butyl-phenolNSC13086ChemDiv1_022149Oprea1_153359CBDivE_008809
Show more names
MLS000776983SCHEMBL6057546CHEMBL1477888HMS649O17HKFRBBJLBRGTLM-UHFFFAOYSA-NHMS2749B05NSC-13086STK525410
Database identifiers
- CAS
32857-07-1- PubChem CID
- 224533
- DTXSID
DTXSID80279535- ChEMBL
CHEMBL1477888- Nikkaji
- J1.533.943H
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 285
Experimental & physicochemical properties
Solubility0.8 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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