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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)-

2,4-Hexadiyne

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Chemical Name: 2,4-Hexadiyne
CAS Number: 2809-69-0
Product Number: AG003FVG(AGN-PC-0JMPNK)
Synonyms:
MDL No:
Molecular Formula: C6H6
Molecular Weight: 78.11184

Identification/Properties

Properties
BP:
129.5°C
Computed Properties
Molecular Weight:
78.114g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
1
Exact Mass:
78.047g/mol
Monoisotopic Mass:
78.047g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
118
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


2,4-Hexadiyne, also known as diphenylethyne, is a versatile compound commonly used in chemical synthesis. Its unique structure containing two alkyne functional groups makes it an important building block in organic chemistry. In chemical synthesis, 2,4-Hexadiyne serves as a key intermediate for the preparation of various functionalized compounds. Its reactivity allows for the introduction of additional substituents or functional groups, making it valuable for the creation of complex organic molecules. Additionally, 2,4-Hexadiyne can undergo cross-coupling reactions with other organic compounds to form new carbon-carbon bonds, further expanding its utility in synthetic chemistry. Overall, 2,4-Hexadiyne plays a crucial role in the development of novel materials, pharmaceuticals, and agrochemicals through its application in chemical synthesis.