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Tertiary-butylhydroperoxide (TBHP), also known as tert-butyl hydroperoxide or 1,1-dimethylethyl hydroperoxide, is a colorless, highly reactive, and unstable organic compound with the chemical formula C4H10O2. It is an important industrial oxidizing agent and radical initiator, widely used in various chemical reactions, such as the synthesis of organic compounds, polymerization processes, and the production of pharmaceuticals. TBHP is a powerful source of alkoxy radicals, which makes it a valuable reagent in organic synthesis, particularly for the oxidation of alcohols to aldehydes or ketones. However, due to its high reactivity and potential to decompose explosively, it requires careful handling and storage under controlled conditions.

5618-63-3

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5618-63-3 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 5618-63-3 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,6,1 and 8 respectively; the second part has 2 digits, 6 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 5618-63:
(6*5)+(5*6)+(4*1)+(3*8)+(2*6)+(1*3)=103
103 % 10 = 3
So 5618-63-3 is a valid CAS Registry Number.

5618-63-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-hydroperoxy-2-methylpropane

1.2 Other means of identification

Product number -
Other names Isobutyl-hydroperoxyd

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:5618-63-3 SDS

5618-63-3Upstream product

5618-63-3Relevant academic research and scientific papers

Oxidations by the system 'hydrogen peroxide-manganese(IV) complex- acetic acid' - Part II: Hydroperoxidation and hydroxylation of alkanes in acetonitrile

Shul'pin, Georgiy B.,Suess-Fink, Georg,Lindsay Smith, John R.

, p. 5345 - 5358 (2007/10/03)

Higher alkanes (cyclohexane, n-pentane, n-heptane, methylbutane, 2- and 3-methylpentanes, 3-methylhexane, cis- and trans-decalins) are oxidized at 20 °C by H2O2 in air in acetonitrile (or nitromethane) solution in the presence of the manganese(IV) salt [L2Mn2O3](PF6)2 (L = 1,4,7-trimethyl- 1,4-7-triazacyclononane) as the catalyst. An obligatory component of the reaction mixture is acetic acid. Turnover numbers attain 3300 after 2 h, the yield of oxygenated products is 46% based on the alkane. The oxidation affords initially the corresponding alkyl hydroperoxide as the predominant product, however later these compounds decompose to produce the corresponding ketones and alcohols. Regio- and bond selectivities of the reaction are high: C(1): C(2): C(3): C(4) ? 1: 40: 35: 35 and 1°: 2°: 3°is 1: (15-40): (180-300). The reaction with both isomers of decalin gives (after treatment with PPh3) alcohols hydroxylated in the tertiary positions with the cis/trans ratio of ~2 in the case of cis-decalin, and of ~30 in the case of trans-decalin (i.e. in the latter case the reaction is stereospecific). Light alkanes (methane, ethane, propane, normal butane and isobutane) can be also easily oxidized by the same reagent in acetonitrile solution, the conditions being very mild: low pressure (1-7 bar of the alkane) and low temperature (- 22 to +27°C). Catalyst turnover numbers attain 3100, the yield of oxygenated products is 22% based on the alkane. The yields of oxygenates are higher at low temperatures. The ratio of products formed (hydroperoxide: ketone: alcohol) depends very strongly on the conditions of the reaction and especially on the catalyst concentration (at higher catalyst concentration the ketone is predominantly produced).

Oxidations by the reagent 'O2-H2O2-vanadium complex-pyrazine-2-carboxylic acid' - VIII. Efficient oxygenation of methane and other lower alkanes in acetonitrile

Nizova, Galina V.,Suess-Fink, Georg,Shul'pin, Georgiy B.

, p. 3603 - 3614 (2007/10/03)

Methane, ethane, propane, n-butane and isobutane can be readily oxidized in acetonitrile solution by air and H2O2 at 20-75°C using the catalytic system [n-Bu4N]VO3/pyrazine-2-carboxylic acid, Apart from alkyl hydroperoxides which are the primary oxidation products, more stable derivatives (alcohols, aldehydes or ketones and carboxylic acids) are obtained with high total turnover numbers (e.g., at 75°C after 4 h: 420 for methane and 2130 for ethane). It was shown in the case of ethane and cyclohexane that alkanes do not yield oxygenated products in the absence of air. The cyclohexane oxidation under an 18O2 atmosphere showed a high degree of 18O incorporation into the oxygenated products. Thus in the oxidation reaction described here H2O2 is only the promoter while O2 is the 'true' oxidant.

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