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ChemicalBook--->CAS DataBase List--->13122-18-4

13122-18-4

13122-18-4 Structure

13122-18-4 Structure
IdentificationBack Directory
[Name]

tert-Butyl peroxy-3,5,5-trimethylhexanoate
[CAS]

13122-18-4
[Synonyms]

42s
Trigonox 42
Perbutyl 355
trigonox®
trigonox 42s
tert-Butylperisononanoate
t-butyl 3,3,5-trimethylperoxyhexanoate
t-Butyl peroxy-3,5,5-trimethyl hexanoate
tert-butyl 3,5,5-trimethylperoxyhexanoate
TERT-BUTYL PEROXY-3,5,5-TRIMETHYLHEXANOATE
tert.-Butylperoxy-3,5,5,-trimethylhexanoat
3,5,5-Trimethylhexaneperoxoic acid tert-butyl
tert-Butyl peroxy-3,5,5-trimethylhexanoate,97%
3,5,5-Trimethylhexaneperoxoic acid tert-butyl ester
3,5,5-Trimethylperoxyhexanoic acid tert-butyl ester
Hexaneperoxoicacid,3,5,5-trimethyl-,1,1-dimethylethylester
HEXANEPEROXOICACID,3,4,4-TRIMETHYL-,1,1-DIMETHYLETHYLESTER
[EINECS(EC#)]

236-050-7
[Molecular Formula]

C13H26O3
[MDL Number]

MFCD00126885
[MOL File]

13122-18-4.mol
[Molecular Weight]

230.34
Chemical PropertiesBack Directory
[Appearance]

clear liquid
[Melting point ]

-30 °C
[Boiling point ]

312.34°C (rough estimate)
[density ]

0.897
[vapor pressure ]

3Pa at 30.05℃
[refractive index ]

1.4295-1.4315
[storage temp. ]

Refrigerator (+4°C)
[Water Solubility ]

partly miscible
[InChI]

InChI=1S/C13H26O3/c1-10(9-12(2,3)4)8-11(14)15-16-13(5,6)7/h10H,8-9H2,1-7H3
[InChIKey]

VSJBBIJIXZVVLQ-UHFFFAOYSA-N
[SMILES]

C(OOC(C)(C)C)(=O)CC(C)CC(C)(C)C
[LogP]

4.4 at 25℃
[CAS DataBase Reference]

13122-18-4
[EPA Substance Registry System]

Hexaneperoxoic acid, 3,5,5-trimethyl-, 1,1-dimethylethyl ester(13122-18-4)
Hazard InformationBack Directory
[Chemical Properties]

clear liquid
[General Description]

This peroxide is sensitive to heat. Storage of tert-Butyl peroxy-3,5,5-trimethylhexanoate must be done so with stringent temperature control measures.
[Air & Water Reactions]

No rapid reaction with air. No rapid reaction with water.
[Reactivity Profile]

TERT-BUTYL PEROXY-3,5,5-TRIMETHYL HEXANOATE explodes with great violence when rapidly heated to a critical temperature; pure form is shock sensitive and detonable [Bretherick 1979 p. 602].
[Flammability and Explosibility]

Notclassified
Safety DataBack Directory
[Hazard Codes ]

Xi-O,Xi,O
[Risk Statements ]

7-38
[Safety Statements ]

36/37/39-3/7-26-14A
[RIDADR ]

UN 2104
[HS Code ]

29159000
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

tert-Butyl peroxy-3,5,5-trimethylhexanoate(13122-18-4).msds
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