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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)-

2-thiophen-2-ylethyl (Z)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoate

N#C/C(=Cc1ccc(c(c1)O)O)/C(=O)OCCc1cccs1 Request for Quotation
Chemical Name: 2-thiophen-2-ylethyl (Z)-2-cyano-3-(3,4-dihydroxyphenyl)prop-2-enoate
CAS Number: 132465-10-2
Product Number: AG0010P1(AGN-PC-078564)
Synonyms:
MDL No: MFCD00894731
Molecular Formula: C16H13NO4S
Molecular Weight: 315.3437

Identification/Properties

Computed Properties
Molecular Weight:
315.343g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
6
Exact Mass:
315.057g/mol
Monoisotopic Mass:
315.057g/mol
Topological Polar Surface Area:
119A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
470
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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


The compound (E)-2-(Thiophen-2-yl)ethyl 2-cyano-3-(3,4-dihydroxyphenyl)acrylate is a versatile molecule that finds wide application in chemical synthesis. Specifically, it is commonly used as a key building block in the synthesis of organic compounds such as pharmaceuticals, agrochemicals, and functional materials.Its unique structure allows for facile modification and introduction of various functional groups, making it a valuable tool in the construction of more complex molecules. The presence of both thiophene and phenolic moieties further enhances its utility by providing opportunities for diverse chemical reactions such as cross-coupling, oxidation, and cyclization.In chemical synthesis, (E)-2-(Thiophen-2-yl)ethyl 2-cyano-3-(3,4-dihydroxyphenyl)acrylate serves as a valuable intermediate in the preparation of biologically active compounds and advanced materials. Its ability to undergo selective transformations under mild reaction conditions makes it an attractive candidate for the development of novel molecular structures with desired properties.