Basic information
- CAS
2349-78-2- Standard SMILES
CC(C)c1cc(O)c(C(C)(C)C)cc1O- InChIKey
WBQXBMIEQDOXPF-UHFFFAOYSA-N- Molecular formula
- C13H20O2
- Average molar mass
- 208.3 g/mol
- Monoisotopic mass
- 208.14632988
Names & identifiers
- Preferred name
- 2-Tert-butyl-5-(propan-2-yl)benzene-1,4-diol
- IUPAC
- 2-tert-butyl-5-propan-2-ylbenzene-1,4-diol
Names & synonyms
2349-78-22-tert-butyl-5-(propan-2-yl)benzene-1,4-diolDTXSID50298531RefChem:267149DTXCID90249668NSC124043SCHEMBL123938575-t-butyl-2-isopropylhydroquinoneNSC-124043
Database identifiers
- CAS
2349-78-2- PubChem CID
- 276331
- DTXSID
DTXSID50298531
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 205
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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