2-methyoxypropene
Product Information
Molecular Formula
C4H8O
Molecular Weight
72.10572
Description
2-Methoxypropene is a multifaceted chemical compound that is a pivotal reagent for syntheses and pharmaceutical preparations. 2-Methoxypropene can be used in drug synthesis including antiviral drugs and powerful anticancer drugs. In addition, it has applications in drug research for diseases related to inflammation, oxidative stress and neurodegeneration.
Synonyms
2-methoxyprop-1-ene; 2-Methoxypropene; Isopropenylmethylether; 1-Propene,2-methoxy-; 116-11-0; 2-Methoxy-1-propene
IUPAC Name
2-methoxyprop-1-ene
SMILES
CC(=C)OC
InChI
InChI=1S/C4H8O/c1-4(2)5-3/h1H2,2-3H3
InChI Key
YOWQWFMSQCOSBA-UHFFFAOYSA-N
Boiling Point
34-36°C
Flash Point
-25 °C
Purity
95%
Density
0.753
Appearance
clear colorless liquid
Application
Used as a laboratory reagent and an intermediate for 2-methoxyallyl bromide (an alkylating agent).
Storage
2-8°C
Refractive Index
1.38
Vapor Pressure
517.0 [mmHg]
Safety Information
Hazards
H224:
Extremely flammable liquid and vapour.
H302:
Harmful if swallowed.
Extremely flammable liquid and vapour.
H302:
Harmful if swallowed.
Precautionary Statement
P210:
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P233:
Keep container tightly closed.
P264:
Wash thoroughly after handling.
P370+P378:
In case of fire:
Use for extinction:
P403+P235:
Store in a well ventilated place.
Keep cool.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P233:
Keep container tightly closed.
P264:
Wash thoroughly after handling.
P370+P378:
In case of fire:
Use for extinction:
P403+P235:
Store in a well ventilated place.
Keep cool.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Computed Properties
XLogP3
1.2
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
1
Exact Mass
72.057514874 g/mol
Monoisotopic Mass
72.057514874 g/mol
Topological Polar Surface Area
9.2Ų
Heavy Atom Count
5
Formal Charge
0
Complexity
38.9
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
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114198994-A | Crystallization drying method capable of accurately monitoring water content in biological sugar preparation process | 2022-02-18 |
| CN-114057712-A | Method for synthesizing chiral phenyl oxazolidine-2-ketone | 2021-12-03 |
| CN-113979847-A | Method for synthesizing 6-methyl-5-octen-2-one by carbonyl-ene reaction | 2021-11-30 |
| CN-113999096-A | Method for synthesizing 6-methyl-5-octen-2-one by condensation hydrogenation | 2021-11-29 |
| CN-114149310-A | Preparation method of unsaturated ketone | 2021-11-23 |
| CN-113999100-A | Preparation of methyl heptenone and method for mechanically applying raw materials | 2021-10-29 |
| CN-113666906-A | Synthesis method of 2-chloro-1- (2, 2-dimethyl-4H-benzo [1,3] dioxin-6-yl) ethanone | 2021-09-23 |
| CN-113679690-A | Theophylline dry powder preparation and preparation method and application thereof | 2021-09-06 |
| KR-102325062-B1 | a method for manufacturing 3-O-alkyl-ascorbic acid | 2021-08-15 |
| CN-113880799-A | Intermediate compound for preparing paclitaxel, synthesis method thereof and synthesis method of paclitaxel | 2021-08-06 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 20933224 | 2010-11-22 | Glycosyl hydroperoxides derived from 2-deoxysugars | Carbohydrate research |
| 20538265 | 2010-07-19 | Acetonation of L-pentoses and 6-deoxy-L-hexoses under kinetic control using heterogeneous acid catalysts | Carbohydrate research |
| 18641373 | 2008-12-01 | Preparation of pure lipid hydroperoxides | Journal of lipid research |
| 18522416 | 2008-07-04 | Identification of the aromatic tertiary N-oxide functionality in protonated analytes via ion/molecule reactions in mass spectrometers | The Journal of organic chemistry |
| 17253805 | 2007-02-02 | Mechanism and chemoselectivity of the Pd(II)-catalyzed allylation of aldehydes: a density functional theory study | The Journal of organic chemistry |
| 14624592 | 2003-11-26 | Exclusive formation of alpha-methyleneoxetanes in ketene-alkene cycloadditions. Evidence for intervention of both an alpha-methyleneoxetane and the subsequent 1,4-zwitterion | Journal of the American Chemical Society |
| 11902873 | 2002-03-27 | Asymmetric catalysis of hetero-ene reactions with tridentate Schiff base chromium(III) complexes | Journal of the American Chemical Society |
| 11814440 | 2002-02-05 | Mixed acetals of cyclodextrins. Preparation of hexakis-, heptakis- and octakis[2,6-di-O-(methoxydimethyl)methyl]-alpha-, beta- and gamma-cyclodextrins | Carbohydrate research |
| 11506155 | 2001-01-01 | A new mixed acetal-type substitution pattern for alpha-cyclodextrin. Preparation of hexakis (3-O-benzyl)- alpha-cyclodextrin | Carbohydrate letters |
