2,2-Bis(tert-butylperoxy)butane

C₁₂H₂₆O₄CAS 2167-23-9234.34 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₂₆O₄
Molar mass: 234.34 g/mol
Exact mass: 234.1831 Da
Boiling point: 41 °C (at 1 Torr)
logP: 3.61Crippen estimate
Polar surface area: 36.9 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 5

Hazards

Danger

H224 Extremely flammable liquid and vapor24.2% of notifiers
H240 Heating may cause an explosion18.1% of notifiers
H242 Heating may cause a fire81.9% of notifiers
H315 Causes skin irritation42.3% of notifiers
H318 Causes serious eye damage18.1% of notifiers
H319 Causes serious eye irritation24.2% of notifiers
H335 May cause respiratory irritation18.1% of notifiers
H413 May cause long lasting harmful effects to aquatic life57.7% of notifiers

Aggregated from 215 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P234, P235, P240, P241, P242, P243, P261, P264, P264+P265, P271, P273, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P370+P372+P380+P373, P370+P378, P403, P403+P233, P403+P235, P405, P410, P411, P420, P501

Identifiers

CAS number

2167-23-9

SMILES

CCC(C)(OOC(C)(C)C)OOC(C)(C)C

InChIKey

HQOVXPHOJANJBR-UHFFFAOYSA-N

InChI

InChI=1S/C12H26O4/c1-9-12(8,15-13-10(2,3)4)16-14-11(5,6)7/h9H2,1-8H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

24 names · show all

Peroxide, 1,1′-(1-methylpropylidene)bis[2-(1,1-dimethylethyl)
Trigonox D-C 50
2,2-Bis(tert-butylperoxybutane)
Luperox 220M50
2,2-Di-tert-butylperoxybutane
Peroxide, sec-butylidenebis[tert-butyl
Peroxide, (1-methylpropylidene)bis[(1,1-dimethylethyl)
1,1′-(1-Methylpropylidene)bis[2-(1,1-dimethylethyl) peroxide]
3,4,6,7-Tetraoxanonane, 5-ethyl-2,2,5,8,8-pentamethyl-
VP 1200
2,2-Di(tert-butylperoxy)butane
Chaloxyd P 1293AL
Chaloxyd P 1200AL
Lupersol 220
Trigonox DB 50
2,2-Bis(tert-butyldioxy)butane
Trigonox DM 50
sec-Butylidenebis[tert-butyl peroxide]
Perhexa 22
Trigonox D
Trigonox D-E 50
Perhexa 22-50S
NSC 5626
DB 50

Work with 2,2-Bis(tert-butylperoxy)butane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Methyl ethyl ketone peroxide1338-23-454 % similar Di-tert-butyl peroxide110-05-450 % similar 2-Ethyl-2-methyl-1,3-dioxolane126-39-648 % similar 2,5-Dimethyl-2,5-di(tert-butylperoxy)hexane78-63-742 % similar 1,1-Bis(tert-butylperoxy)cyclohexane3006-86-838 % similar 2,5-Dimethyl-2,5-di(tert-butylperoxy)hexyne-31068-27-536 % similar Ethyl tert-butyl ether637-92-333 % similar Bis(tert-butylperoxyisopropyl)benzene25155-25-332 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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