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2-Methoxyethyl acetate - 98%, high purity , CAS No.110-49-6
Basic Description
Synonyms
Methyl cellosolye acetaat [Dutch] | CCRIS 5832 | MeCsac | UN 1189 | 2-Methoxyethyle, acetate de [French] | Aethylenglykolmethylaetheracetat [German] | Q2415195 | AI3-11272 | EGMEA | Methyl cellosolye acetaat | Diethylene glycol methyl ether acetate | Ethy
Specifications & Purity
≥98%
Storage Temp
Room temperature
Shipped In
Normal
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Carboxylic acid derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Carboxylic acid esters
Alternative Parents
Monocarboxylic acids and derivatives Dialkyl ethers Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Carboxylic acid ester - Monocarboxylic acid or derivatives - Ether - Dialkyl ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group).
External Descriptors
Not available
Data sources
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Names and Identifiers
Pubchem Sid
488180670
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488180670
IUPAC Name
2-methoxyethyl acetate
INCHI
InChI=1S/C5H10O3/c1-5(6)8-4-3-7-2/h3-4H2,1-2H3
InChIKey
XLLIQLLCWZCATF-UHFFFAOYSA-N
Smiles
CC(=O)OCCOC
Isomeric SMILES
CC(=O)OCCOC
WGK Germany
1
RTECS
KL5950000
UN Number
1189
Packing Group
III
Molecular Weight
118.13
Beilstein
1700761
Reaxy-Rn
1700761
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1700761&ln=
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Solubility
Soluble in water, miscible in most organic solvents.
Refractive Index
1.4
Flash Point(°F)
114.8 °F
Flash Point(°C)
46°C
Boil Point(°C)
145°C
Melt Point(°C)
-65-146°C
Molecular Weight
118.130 g/mol
XLogP3
0.000
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
4
Exact Mass
118.063 Da
Monoisotopic Mass
118.063 Da
Topological Polar Surface Area
35.500 Ų
Heavy Atom Count
8
Formal Charge
0
Complexity
70.100
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
The total count of all stereochemical bonds
0
Covalently-Bonded Unit Count
1
Citations of This Product
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