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tert-Butyl isopropyl benzene hydroperoxide

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Name

tert-Butyl isopropyl benzene hydroperoxide

EINECS N/A
CAS No. 30026-92-7 Density 0.953g/cm3
PSA 18.46000 LogP 3.66840
Solubility N/A Melting Point N/A
Formula C13H20 O2 Boiling Point 249.4°Cat760mmHg
Molecular Weight 208.33 Flash Point 73.2°C
Transport Information N/A Appearance N/A
Safety Powerful irritant. See also PEROXIDES, ORGANIC. Dangerous fire hazard when exposed to heat or flame or by chemical reaction. Incompatible with oxidizing or reducing materials. When heated to decomposition it emits acrid smoke and fumes. Risk Codes N/A
Molecular Structure Molecular Structure of 30026-92-7 (Hydroperoxide,1-[(1,1-dimethylethyl)phenyl]-1-methylethyl (9CI)) Hazard Symbols N/A
Synonyms

Hydroperoxide,tert-butyl-a,a-dimethylbenzyl (6CI,8CI)

 

tert-Butyl isopropyl benzene hydroperoxide Chemical Properties

Molecule structure of tert-Butyl isopropyl benzene hydroperoxide (CAS NO.30026-92-7) :

IUPAC Name: 2-tert-butylperoxypropan-2-ylbenzene 
Molecular Weight: 208.2967 g/mol
Molecular Formula: C13H20O2 
Density: 0.953 g/cm3 
Boiling Point: 249.4 °C at 760 mmHg 
Flash Point: 73.2 °C
Index of Refraction: 1.479
Molar Refractivity: 61.99 cm3
Molar Volume: 218.4 cm3
Polarizability: 24.57×10-24 cm3
Surface Tension: 29.5 dyne/cm 
Enthalpy of Vaporization: 46.69 kJ/mol
Vapour Pressure: 0.0364 mmHg at 25 °C
XLogP3-AA: 3.2
H-Bond Acceptor: 2
Rotatable Bond Count: 4
Exact Mass: 208.14633
MonoIsotopic Mass: 208.14633
Topological Polar Surface Area: 18.5
Heavy Atom Count: 15
Complexity: 185
Canonical SMILES: CC(C)(C)OOC(C)(C)C1=CC=CC=C1
InChI: InChI=1S/C13H20O2/c1-12(2,3)14-15-13(4,5)11-9-7-6-8-10-11/h6-10H,1-5H3
InChIKey: BIISIZOQPWZPPS-UHFFFAOYSA-N

tert-Butyl isopropyl benzene hydroperoxide Safety Profile

Powerful irritant. See also PEROXIDES, ORGANIC. Dangerous fire hazard when exposed to heat or flame or by chemical reaction. Incompatible with oxidizing or reducing materials. When heated to decomposition it emits acrid smoke and fumes.

tert-Butyl isopropyl benzene hydroperoxide Specification

 tert-Butyl isopropyl benzene hydroperoxide (CAS NO.30026-92-7) is also called 1-((1,1-Dimethylethyl)phenyl)-1-methylethyl hydroperoxide ; Hydroperoxide, 1-((1,1-dimethylethyl)phenyl)-1-methylethyl . tert-Butyl isopropyl benzene hydroperoxide (CAS NO.30026-92-7) is sensitive to heat. Storage of  tert-Butyl isopropyl benzene hydroperoxide (CAS NO.30026-92-7) must be done so with stringent temperature control measures. Most alkyl monohydroperoxides are liquid. The explosivity of the lower members (e.g., methyl hydroperoxide, or possibly traces of the dialkyl peroxides) decreases with increasing chain length and branching.  tert-Butyl isopropyl benzene hydroperoxide (CAS NO.30026-92-7) will produce toxic spicy stimulate smoke by heat. So the storage environment should be ventilate, low-temperature and dry. Keep tert-Butyl isopropyl benzene hydroperoxide (CAS NO.30026-92-7) separate from oxidant and reducing agent.

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