o-Cresol, 4-tert-butyl-alpha-(p-chlorophenyl)-
Basic information
- CAS
20121-09-9- Standard SMILES
CC(C)(C)c1ccc(O)c(Cc2ccc(Cl)cc2)c1- InChIKey
GMXYMQVEBDBUGZ-UHFFFAOYSA-N- Molecular formula
- C17H19ClO
- Average molar mass
- 274.8 g/mol
- Monoisotopic mass
- 274.1124429
Names & identifiers
- Preferred name
- o-Cresol, 4-tert-butyl-alpha-(p-chlorophenyl)-
- IUPAC
- 4-tert-butyl-2-[(4-chlorophenyl)methyl]phenol
Names & synonyms
o-Cresol, 4-tert-butyl-alpha-(p-chlorophenyl)-20121-09-92-(4'-Chlorobenzyl)-4-t-butylphenol4-tert-Butyl-alpha-(p-chlorophenyl)-o-cresolDTXSID40173944RefChem:366418DTXCID00964354-tert-butyl-2-[(4-chlorophenyl)methyl]phenol
Database identifiers
- CAS
20121-09-9- PubChem CID
- 209683
- DTXSID
DTXSID40173944
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 275
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Compound notes
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