1,2-Epoxyisobutane

Product Information

Molecular Formula:
C4H8O
Molecular Weight:
72.11
Description
2,2-Dimethyloxirane is an epoxide.
Synonyms
1,1-Dimethyloxirane,1,2-Epoxy-isobutane,Isobutylene oxide
IUPAC Name
2,2-dimethyloxirane
Canonical SMILES
CC1(CO1)C
InChI
InChI=1S/C4H8O/c1-4(2)3-5-4/h3H2,1-2H3
InChI Key
GELKGHVAFRCJNA-UHFFFAOYSA-N
Boiling Point
50-51 °C (lit.)
Flash Point
-26.5 °CF
Purity
0.97
Density
0.812 g/mL at 25 °C (lit.)
Solubility
58 mg/mL at 20 °C
Refractive Index
n20/D 1.374 (lit.)
Vapor Pressure
387.0 [mmHg]

Safety Information

Hazards
H225 - H314 - H341 - H351
Precautionary Statement
P201 - P210 - P280 - P301 + P330 + P331 - P303 + P361 + P353 - P305 + P351 + P338

Computed Properties

XLogP3
0.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
0
Exact Mass
72.057514874 g/mol
Monoisotopic Mass
72.057514874 g/mol
Topological Polar Surface Area
12.5Ų
Heavy Atom Count
5
Formal Charge
0
Complexity
47.6
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

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CN-113897165-A Detachable polyurethane hot melt adhesive and preparation raw material, preparation method and bonding method thereof 2021-11-26
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CN-113321668-A Synthesis of serpatatinib 2021-06-21
CN-113461660-A 2,4, 6-trisubstituted-1, 3, 5-s-triazine compound, preparation and application thereof 2021-06-11
CN-113024795-A Method for synthesizing polyether polyol or monohydric alcohol 2021-05-07
CN-113292530-A Method for preparing cyclic carbonate from quaternary phosphonium salt 2021-04-30
CN-113000070-A Fluorine-containing super-hydrophobic modified MOFs material and application thereof as catalyst in catalytic preparation of cyclic carbonate 2021-03-11
CN-112724907-A Light-moisture-curing polyurethane hot-melt adhesive for bonding opaque substrates and preparation method thereof 2020-12-29
CN-112724915-A Reactive polyurethane hot melt adhesive with multiple curing modes and preparation method thereof 2020-12-29

Literatures

PMID Publication Date Title Journal
25576605 2015-03-01 Metabolism of 2-methylpropene (isobutylene) by the aerobic bacterium Mycobacterium sp. strain ELW1 Applied and environmental microbiology
21563767 2011-06-06 Aluminum nanoparticles capped by polymerization of alkyl-substituted epoxides: ratio-dependent stability and particle size Inorganic chemistry
21384814 2011-04-01 Protecting group free synthesis of 6-substituted naphthols and binols The Journal of organic chemistry
19746393 2009-09-01 HPLC with polysaccharide chiral stationary phase in polar-organic phase mode: application to the asymmetric epoxidation of allylic alcohols Journal of separation science
19583230 2009-08-18 Capping and passivation of aluminum nanoparticles using alkyl-substituted epoxides Langmuir : the ACS journal of surfaces and colloids
19007156 2008-12-15 An exploration of the coupling reactions of epoxides and carbon dioxide catalyzed by tetramethyltetraazaannulene chromium(III) derivatives: formation of copolymers versus cyclic carbonates Inorganic chemistry
18335484 2008-09-01 Fast generation of nonresonant and resonant optical rotatory dispersion curves with the help of circular dichroism calculations and Kramers-Kronig transformations Chirality
18718141 2008-08-01 Determination of residual isobutylene oxide--a genotoxic starting material in a drug substance by static headspace gas chromatography Journal of chromatographic science
17101190 2007-02-20 Evaluation of the in-situ aerobic cometabolism of chlorinated ethenes by toluene-utilizing microorganisms using push-pull tests Journal of contaminant hydrology
17194116 2007-01-05 How well can new-generation density functionals describe protonated epoxides where older functionals fail? The Journal of organic chemistry
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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