Basic information
- CAS
68084-51-5- Standard SMILES
CCc1cc(C(C)C)cc(O)c1C- InChIKey
QTWMLLOLEYPWJU-UHFFFAOYSA-N- Molecular formula
- C12H18O
- Average molar mass
- 178.27 g/mol
- Monoisotopic mass
- 178.13576519
Names & identifiers
- Preferred name
- Phenol, ethyl-2-methyl-5-(1-methylethyl)-
- IUPAC
- 3-ethyl-2-methyl-5-propan-2-ylphenol
- English name
- ethyl-5-isopropyl-o-cresol
- Molecular formula
- C12H18O
- Molecular weight
- 178.27072
Names & synonyms
Phenol, ethyl-2-methyl-5-(1-methylethyl)-68084-51-5EINECS 268-441-3ar-Ethyl-2-methyl-5-(1-methylethyl)-phenolDTXSID2071077RefChem:172852DTXCID30455103-ethyl-5-isopropyl-2-methylphenol3-ethyl-2-methyl-5-propan-2-ylphenolEthyl-5-isopropyl-o-cresolQTWMLLOLEYPWJU-UHFFFAOYSA-NMFCD00069486
Show more names
3-ethyl-5-isopropyl-2-methyl-phenol1824502-80-83-Ethyl-2-methyl-5-(propan-2-yl)phenolNS00036402
Database identifiers
- CAS
68084-51-5- PubChem CID
- 106565
- DTXSID
DTXSID2071077- EC Number
- 268-441-3
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- EPA Substance Registry System
- -2 · Phenol, ethyl-2-methyl-5-(1-methylethyl)- (68084-51-5)
- 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.
Hazard information
Regulatory InformationChemical: Phenol, ethyl-2-methyl-5-(1-methylethyl)-
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhenol, ethyl-2-methyl-5-(1-methylethyl)-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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