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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-Butenedinitrile, 2-(1,1-dimethylethyl)-, (2Z)-

N#C/C=C(/C(C)(C)C)C#N Request for Quotation
Chemical Name: 2-Butenedinitrile, 2-(1,1-dimethylethyl)-, (2Z)-
CAS Number: 169309-80-2
Product Number: AG00AOL5(AGN-PC-0O4SIP)
Synonyms:
MDL No: MFCD12405597
Molecular Formula: C8H10N2
Molecular Weight: 134.1784

Identification/Properties

Computed Properties
Molecular Weight:
134.182g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
134.084g/mol
Monoisotopic Mass:
134.084g/mol
Topological Polar Surface Area:
47.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
235
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

GHS Pictogram:
Signal Word:
Danger
UN#:
2810
Hazard Statements:
H301-H311-H331
Precautionary Statements:
P261-P280-P301+P310-P311
Class:
6.1
Packing Group:
Ⅲ

NMR Spectrum

Other Analytical Data

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Chemical Structure


cis-2-(tert-Butyl)maleonitrile is a valuable compound utilized in chemical synthesis processes. This unique molecule serves as a versatile building block in organic synthesis, particularly in the creation of complex molecules through various reactions. Its molecular structure, with a tert-butyl group and a maleonitrile moiety arranged in a cis configuration, provides distinct reactivity and stereochemical control in reactions.One of the primary applications of cis-2-(tert-Butyl)maleonitrile is in the preparation of cyclic compounds and functionalized products. Its presence allows for the introduction of the maleonitrile functionality into a variety of organic frameworks, enabling the formation of fused ring systems, heterocyclic compounds, and substituted derivatives. Additionally, the tert-butyl group can serve as a protecting group or a directing group in selective reactions, adding an extra dimension of control to the synthesis process.Due to its unique reactivity profile and stereochemical influence, cis-2-(tert-Butyl)maleonitrile is a valuable tool for synthetic chemists working on the construction of complex molecules with specific structural motifs or stereochemistry requirements. Its versatility and reliability make it a sought-after reagent in the toolkit of organic chemists engaged in the design and synthesis of novel compounds for various applications.