2,4-Diisobutylphenol
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Basic information
- CAS
65152-07-0- Standard SMILES
CC(C)Cc1ccc(O)c(CC(C)C)c1- InChIKey
HODFXOIYAQPWHD-UHFFFAOYSA-N- Molecular formula
- C14H22O
- Average molar mass
- 206.32 g/mol
- Monoisotopic mass
- 206.16706532
Names & identifiers
- Preferred name
- 2,4-Diisobutylphenol
- IUPAC
- 2,4-bis(2-methylpropyl)phenol
- English name
- 2,4-diisobutylphenol
- Molecular formula
- C14H22O
- Molecular weight
- 206.32
Names & synonyms
2,4-Diisobutylphenol65152-07-0Phenol, 2,4-bis(2-methylpropyl)-Phenol, 2,4-diisobutyl-P3052JKW75EINECS 265-566-5DTXSID2070263RefChem:443671DTXCID9044538265-566-52,4-bis(2-methylpropyl)phenol2,4-diisobutyl phenol
Show more names
CHEMBL109774UNII-P3052JKW75SCHEMBL318750HODFXOIYAQPWHD-UHFFFAOYSA-NBDBM50409532NS00035823Q27286055
Database identifiers
- CAS
65152-07-0- PubChem CID
- 103295
- DTXSID
DTXSID2070263- ChEMBL
CHEMBL109774- UNII
- P3052JKW75
- EC Number
- 265-566-5
- Nikkaji
- J307.312B
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 174
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- FDA UNII
- 3052 JKW75 · P3052JKW75
- EPA Substance Registry System
- 2 · Phenol, 2,4-bis(2-methylpropyl)- (65152-07-0)
- 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-bis(2-methylpropyl)-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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