Phenol, 2-butyl-6-isopropyl-
Basic information
- CAS
22496-47-5- Standard SMILES
CCCCc1cccc(C(C)C)c1O- InChIKey
QXVWWADASQRJAU-UHFFFAOYSA-N- Molecular formula
- C13H20O
- Average molar mass
- 192.3 g/mol
- Monoisotopic mass
- 192.15141526
Names & identifiers
- Preferred name
- Phenol, 2-butyl-6-isopropyl-
- IUPAC
- 2-butyl-6-propan-2-ylphenol
Names & synonyms
Phenol, 2-butyl-6-isopropyl-2-Butyl-6-isopropylphenolBRN 304735822496-47-5DTXSID50177019RefChem:369018DTXCID60995102-butyl-6-(propan-2-yl)phenolCHEMBL413316SCHEMBL2672714
Database identifiers
- CAS
22496-47-5- PubChem CID
- 211162
- DTXSID
DTXSID50177019- ChEMBL
CHEMBL413316- Nikkaji
- J79.086I
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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