ISOPRENE MONOXIDE

Product Information

Molecular Formula:
C5H8O
Molecular Weight:
84.12
Description
Isoprene oxide is a clear colorless liquid.
Synonyms
ISOPRENE MONOXIDE; 2-METHYL-2-VINYLOXIRANE; (R,S)-2-Methyl-2-vinyl-oxirane; 1-Butene,3,4-epoxy-3-methyl-; 2-Ethenyl-2-methyloxirane; 2-Methyl-2-vinyloxacyclopropane
IUPAC Name
2-ethenyl-2-methyloxirane
Canonical SMILES
CC1(CO1)C=C
InChI
InChI=1S/C5H8O/c1-3-5(2)4-6-5/h3H,1,4H2,2H3
InChI Key
FVCDMHWSPLRYAB-UHFFFAOYSA-N
Boiling Point
79.5°C
Purity
95%
Density
0.857 g/mL at 25 °C(lit.)
Appearance
Clear colorless liquid.
Storage
2-8°C
Refractive Index
n20/D 1.416 (lit.)

Safety Information

Hazards
H225 - H315 - H319 - H335
Precautionary Statement
P210 - P302 + P352 - P305 + P351 + P338

Computed Properties

XLogP3
0.7
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
1
Exact Mass
84.057514874 g/mol
Monoisotopic Mass
84.057514874 g/mol
Topological Polar Surface Area
12.5Ų
Heavy Atom Count
6
Formal Charge
0
Complexity
78
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-113559783-A Fluorocarbon surfactant and preparation method and application thereof 2021-07-16
CN-113399000-A Catalyst and preparation method thereof, catalyst composition and method for preparing straight-chain alcohol from epoxy compound 2021-06-01
CN-113004296-A General synthetic method for preparing chiral oxygen heterocyclic compound by novel [4+1] and [5+1] cyclization strategies 2021-03-22
WO-2022056053-A1 Polypropylene polymer having ultra-high melt flow rate 2020-09-09
EP-3960783-A1 Isocyanate-terminated prepolymers based on polyoxymethylene-polyoxyalkylene block copolymers, method for their preparation and their use 2020-09-01
WO-2022049012-A1 Isocyanate-terminated prepolymers based on polyoxymethylene-polyoxyalkylene block copolymers, process for the preparation and use thereof 2020-09-01
JP-2022035328-A Liquid crystal polymer composition, method for manufacturing liquid crystal polymer composition, molded product, film, copper-clad laminate, and manufacturing method for molded product. 2020-08-20
JP-2022035329-A Graft-modified polymethylpentene compositions, moldings, and copper-clad laminates 2020-08-20
WO-2022013345-A1 Kit composed of a two-component tissue adhesive and a textile structure for strengthening the connective tissue after an operation, and use thereof 2020-07-17
EP-3932973-A1 Bi-functionalized polysiloxane brush copolymers 2020-07-01

Literatures

PMID Publication Date Title Journal
21548641 2011-07-18 Identification and characterization of 2'-deoxyadenosine adducts formed by isoprene monoepoxides in vitro Chemical research in toxicology
17317274 2007-04-20 DNA-damaging ability of isoprene and isoprene mono-epoxide (EPOX I) in human cells evaluated with the comet assay Mutation research
15925539 2005-08-01 Hemoglobin adducts and micronuclei in rodents after treatment with isoprene monoxide or butadiene monoxide Mutation research
14748589 2004-02-05 Direct vinylogous Mannich-type reactions via ring opening and rearrangement of vinyloxiranes Organic letters
12870896 2003-07-01 Stereochemical and kinetic comparisons of mono- and diepoxide formation in the in vitro metabolism of isoprene by liver microsomes from rats, mice, and humans Chemical research in toxicology
11397393 2001-06-01 Metabolism and molecular toxicology of isoprene Chemico-biological interactions
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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