2,4-Dimethyl-6-tert-octylphenol
Basic information
- CAS
6286-28-8- Standard SMILES
Cc1cc(C)c(O)c(C(C)(C)CC(C)(C)C)c1- InChIKey
ZXLSNLZXWMSDNF-UHFFFAOYSA-N- Molecular formula
- C16H26O
- Average molar mass
- 234.38 g/mol
- Monoisotopic mass
- 234.19836545
Names & identifiers
- Preferred name
- 2,4-Dimethyl-6-tert-octylphenol
- IUPAC
- 2,4-dimethyl-6-(2,4,4-trimethylpentan-2-yl)phenol
- English name
- 6-(1,1,3,3-tetramethylbutyl)-2,4-xylenol
- Molecular formula
- C16H26O
- Molecular weight
- 234.38
Names & synonyms
Phenol, 2,4-dimethyl-6-(1,1,3,3-tetramethylbutyl)-6286-28-82,4-Dimethyl-6-tert-octylphenol10G7886HTKEINECS 228-515-8NSC 10043NSC-100432,4-Xylenol, 6-(1,1,3,3-tetramethylbutyl)-DTXSID3064198RefChem:443764DTXCID90435626-tert-Octyl-2,4-xylenol
Show more names
2,4-Dimethyl-6-(1,1,3,3-tetramethylbutyl)phenol
2,4-dimethyl-6-(2,4,4-trimethylpentan-2-yl)phenolUNII-10G7886HTKNSC100436-(1,1,3,3-Tetramethylbutyl)-2,4-xylenolSCHEMBL11795650SCHEMBL30337530ZXLSNLZXWMSDNF-UHFFFAOYSA-N2, 6-(1,1,3,3-tetramethylbutyl)-
Database identifiers
- CAS
6286-28-8- PubChem CID
- 80496
- DTXSID
DTXSID3064198- UNII
- 10G7886HTK
- EC Number
- 228-515-8
- Nikkaji
- J206.847H
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 249
Physicochemical properties
- Boiling point
- 304.9 · 304.9±11.0 °C(Predicted)
- Density
- 0.925 · 0.925±0.06 g/cm3(Predicted)
- pka
- 10.93 · 10.93±0.48(Predicted)
- FDA UNII
- 10 G7886HTK · 10G7886HTK
- EPA Substance Registry System
- 2 · Phenol, 2,4-dimethyl-6-(1,1,3,3-tetramethylbutyl)- (6286-28-8)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhenol, 2,4-dimethyl-6-(1,1,3,3-tetramethylbutyl)-: INACTIVE
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…