Basic information
- Standard SMILES
CC(C)(C)c1cc(CCl)cc(C(C)(C)C)c1O- InChIKey
TXBWKXFDLINCMJ-UHFFFAOYSA-N- Molecular formula
- C15H23ClO
- Average molar mass
- 254.79 g/mol
- Monoisotopic mass
- 254.14374304
Names & identifiers
- Preferred name
- 2,6-Di-tert-butyl-4-(chloromethyl)phenol
- IUPAC
- 2,6-ditert-butyl-4-(chloromethyl)phenol
Names & synonyms
2,6-Di-tert-butyl-4-(chloromethyl)phenol955-01-1DTXSID60495291RefChem:248101DTXCID00446101Phenol, 4-(chloromethyl)-2,6-bis(1,1-dimethylethyl)-2,6-ditert-butyl-4-(chloromethyl)phenolSCHEMBL98076TXBWKXFDLINCMJ-UHFFFAOYSA-N4-chloromethyl-2,6-di-t-butylphenol2,6-di-t-butyl-4-(chloromethyl)-phenol3,5-di-t-butyl-4-hydroxybenzyl chloride
Show more names
4-chloromethyl-2, 6-di-tert-butylphenol3,5-di-t-butyl-4-hydroxy benzyl chloride4-hydroxy-3,5-di-t-butyl-benzyl chloride3,5-di-tert-butyl-4-hydroxybenzyl chloride3,5-di-tert.butyl-4-hydroxybenzyl chloride
Database identifiers
- CAS
955-01-1- PubChem CID
- 12378601
- DTXSID
DTXSID60495291- Nikkaji
- J2.683.048F
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 225
Related reactions
16 records
Linked notes
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