4-(1-Phenylethyl)-2,6-ditert-butyl-phenol

HCID 331193

Basic information

CAS
17540-76-0
Standard SMILES
CC(c1ccccc1)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1
InChIKey
QAIIXGKSSGKVOU-UHFFFAOYSA-N
Molecular formula
C22H30O
Average molar mass
310.5 g/mol
Monoisotopic mass
310.22966558

Names & identifiers

Preferred name
4-(1-Phenylethyl)-2,6-ditert-butyl-phenol
IUPAC
2,6-ditert-butyl-4-(1-phenylethyl)phenol

Names & synonyms

17540-76-0NSC 3215744-(1-phenylethyl)-2,6-ditert-butyl-phenolNSC321574SCHEMBL7515742DTXSID60317883QAIIXGKSSGKVOU-UHFFFAOYSA-NNSC-321574DS-0144462,6-Di-tert-butyl-4-(1-phenylethyl)phenol2,6-Di-t-butyl-4-(alpha-methylbenzyl)phenol2,6-Di-t-butyl-4-(alpha-methylbenzyl) phenol

Database identifiers

CAS
17540-76-0
PubChem CID
331193
DTXSID
DTXSID60317883

Properties

Computed structural properties

XLogP
7.2
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
23

Related reactions

4 records

Compound notes

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