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3,5-Di-Tert-Butyl-o-Benzoquinone
[CAS# 3383-21-9]

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Identification
Name 3,5-Di-Tert-Butyl-o-Benzoquinone
Synonyms 3,5-Ditert-Butyl-1,2-Benzoquinone; 3,5-Ditert-Butyl-O-Benzoquinone; St5308623
Molecular Structure CAS#: 3383-21-9, 3,5-Di-Tert-Butyl-o-Benzoquinone
Molecular Formula C14H20O2
Molecular Weight 220.31
CAS Registry Number 3383-21-9
EINECS 222-189-0
SMILES CC(C1=CC(=CC(C1=O)=O)C(C)(C)C)(C)C
InChI 1S/C14H20O2/c1-13(2,3)9-7-10(14(4,5)6)12(16)11(15)8-9/h7-8H,1-6H3
InChIKey NOUZOVBGCDDMSX-UHFFFAOYSA-N
Properties
Density 1.0±0.1g/cm3 (Cal.)
Melting point 115°C (Expl.)
Boiling point 302.7±15.0°C at 760 mmHg (Cal.)
Flash point 120.6±6.0°C (Cal.)
Safety Data
Safety Code S26;S37  Details
Risk Code R36/37/38  Details
Hazard Symbol symbol  X  Details
Safety Description IRRITANT
WARNING: Irritates lungs, eyes, skin
Minimize exposure.
SDS Available
References
(1) D.-N. Horng, J.-P. Chyn, K.-J. Shieh, J.-L. Chou and Y.-S. Wen. 3,5-Di-tert-butyl-1,2-benzoquinone, Acta Cryst. (1999). C55, 652-653 
Market Analysis Reports
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