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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Acetic acid, cyano-, 2-propenyl ester

C=CCOC(=O)CC#N Request for Quotation
Chemical Name: Acetic acid, cyano-, 2-propenyl ester
CAS Number: 13361-32-5
Product Number: AG003NPO(AGN-PC-0JKIHC)
Synonyms:
MDL No:
Molecular Formula: C6H7NO2
Molecular Weight: 125.1253

Identification/Properties

Properties
BP:
110 °C20 mm Hg(lit.)
Storage:
Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.443(lit.)
Computed Properties
Molecular Weight:
125.127g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
125.048g/mol
Monoisotopic Mass:
125.048g/mol
Topological Polar Surface Area:
50.1A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
154
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

Safety Information

NMR Spectrum

Other Analytical Data

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Chemical Structure


Allylcyanoacetate is a versatile compound widely utilized in chemical synthesis for its valuable applications. In organic chemistry, it is frequently used as a key building block in the synthesis of various biologically active molecules. Due to its unique chemical structure, Allylcyanoacetate serves as a precursor in the formation of complex organic compounds through various chemical reactions such as condensation, Michael addition, and nucleophilic substitution reactions.Moreover, Allylcyanoacetate plays a crucial role in the production of pharmaceuticals, agrochemicals, and materials with specialized functions. Its ability to undergo multiple types of reactions allows chemists to functionalize the molecule in specific ways, tailoring its properties for desired applications. Additionally, Allylcyanoacetate's presence of both allyl and cyano groups provides opportunities for further derivatization, enabling the synthesis of diverse organic compounds with enhanced functionalities.In summary, Allylcyanoacetate is a valuable intermediate in chemical synthesis, offering a wide range of possibilities for creating intricate organic structures with potential applications in various industries.