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Propargyl methacrylate - ≥ 97%, containing stabilizer, high purity , CAS No.13861-22-8
Basic Description
Synonyms
FT-0636972 | SCHEMBL194435 | prop-2-yn-1-yl 2-methylprop-2-enoate | prop-2-ynyl 2-methylprop-2-enoate | 2-Propynyl methacrylate | Methacrylic acid propargyl ester | AKOS006229392 | EINECS 237-599-5 | Prop-2-ynyl methacrylate | DTXSID8065666 | Propargyl me
Specifications & Purity
≥97%, containing stabilizer
Storage Temp
Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Taxonomic Classification
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Carboxylic acid derivatives
Intermediate Tree Nodes
Carboxylic acid esters - Alpha,beta-unsaturated carboxylic esters
Direct Parent
Enoate esters
Alternative Parents
Monocarboxylic acids and derivatives Acetylides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic acyclic compounds
Substituents
Enoate ester - Acetylide - Monocarboxylic acid or derivatives - 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 enoate esters. These are an alpha,beta-unsaturated carboxylic ester of general formula R1C(R2)=C(R3)C(=O)OR4 (R4= organyl compound) in which the ester C=O function is conjugated to a C=C double bond at the alpha,beta position.
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
504755724
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504755724
IUPAC Name
prop-2-ynyl 2-methylprop-2-enoate
INCHI
InChI=1S/C7H8O2/c1-4-5-9-7(8)6(2)3/h1H,2,5H2,3H3
InChIKey
PZAWASVJOPLHCJ-UHFFFAOYSA-N
Smiles
CC(=C)C(=O)OCC#C
Isomeric SMILES
CC(=C)C(=O)OCC#C
PubChem CID
83778
UN Number
3272
Packing Group
III
Molecular Weight
124.14
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Flash Point(°C)
48°C
Boil Point(°C)
149-151° C
Molecular Weight
124.140 g/mol
XLogP3
1.200
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
3
Exact Mass
124.052 Da
Monoisotopic Mass
124.052 Da
Topological Polar Surface Area
26.300 Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
171.000
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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1 Citations
A2310208