Ethyl methoxyacetate - CAS 3938-96-3

Catalog:	BB023959
Product Name:	Ethyl methoxyacetate
CAS:	3938-96-3
Synonyms:	ethyl 2-methoxyacetate

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Computed Properties

IUPAC Name:	ethyl 2-methoxyacetate
Description:	Ethyl methoxyacetate (CAS# 3938-96-3) is a useful research chemical.
Molecular Weight:	118.13
Molecular Formula:	C5H10O3
Canonical SMILES:	CCOC(=O)COC
InChI:	InChI=1S/C5H10O3/c1-3-8-5(6)4-7-2/h3-4H2,1-2H3
InChI Key:	JLEKJZUYWFJPMB-UHFFFAOYSA-N
Boiling Point:	44-45.4 °C (9 mmHg)
Density:	1.007 g/cm³
Appearance:	Colorless liquid
MDL:	MFCD00009176
LogP:	0.19590

Publication Number	Title	Priority Date
CN-113121565-A	Organic compound, and electronic element and electronic device using same	20210326
JP-2021063999-A	Colored photosensitive resin composition	20210104
CN-112940007-A	Organic compound, and organic electroluminescent device and electronic device using same	20201127
CN-112608220-A	Synthetic method of 3, 5-difluorophenol	20201126
CN-112028079-A	Enzyme-loaded silicon oxide millimeter ball and preparation method and application thereof	20200831

PMID	Publication Date	Title	Journal
21971988	20111207	Enzymatic enantiomeric resolution of phenylethylamines structurally related to amphetamine	Organic & biomolecular chemistry
21627134	20110715	Chemoenzymatic asymmetric synthesis of optically active pentane-1,5-diamine fragments by means of lipase-catalyzed desymmetrization transformations	The Journal of organic chemistry
20566058	20100101	Hydration structure of poly(2-methoxyethyl acrylate): comparison with a 2-methoxyethyl acetate model monomer	Journal of biomaterials science. Polymer edition
17291005	20070315	Dynamic kinetic resolution of primary amines with a recyclable Pd nanocatalyst for racemization	Organic letters
16991170	20061101	Molecular basis for the enhanced lipase-catalyzed N-acylation of 1-phenylethanamine with methoxyacetate	Chembiochem : a European journal of chemical biology

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GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501
Signal Word:	Warning

Complexity:	70.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	118.062994177
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	118.062994177
Rotatable Bond Count:	4
Topological Polar Surface Area:	35.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4