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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)-

1H-1,2,4-Triazole-3-acetonitrile, 5-methyl-

Cc1nc([nH]n1)CC#N Request for Quotation
Chemical Name: 1H-1,2,4-Triazole-3-acetonitrile, 5-methyl-
CAS Number: 86999-26-0
Product Number: AG004GUK(AGN-PC-0JQ2P5)
Synonyms:
MDL No:
Molecular Formula: C5H6N4
Molecular Weight: 122.1279

Identification/Properties

Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
122.131g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
122.059g/mol
Monoisotopic Mass:
122.059g/mol
Topological Polar Surface Area:
65.4A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
135
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

GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


The compound 2-(3-Methyl-1H-1,2,4-triazol-5-yl)acetonitrile plays a crucial role in chemical synthesis as a versatile building block. It is commonly utilized as a key intermediate in the production of various pharmaceuticals, agrochemicals, and functional materials. Due to its unique structure, this compound serves as a valuable starting material for the synthesis of diverse compounds with potential biological activities. Additionally, its presence in the molecular structure imparts specific properties that are essential for the desired functionality of the end products. Overall, its significance lies in its ability to facilitate the creation of complex organic molecules with tailored properties through strategic chemical transformations.