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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-Triazol-3-amine, 5-(4-bromophenyl)-

Brc1ccc(cc1)c1nnc([nH]1)N Request for Quotation
Chemical Name: 1H-1,2,4-Triazol-3-amine, 5-(4-bromophenyl)-
CAS Number: 54464-13-0
Product Number: AG00DJUT(AGN-PC-0OC25J)
Synonyms:
MDL No: MFCD00846705
Molecular Formula: C8H7BrN4
Molecular Weight: 239.0720

Identification/Properties

Properties
Form:
Solid
Computed Properties
Molecular Weight:
239.076g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
237.985g/mol
Monoisotopic Mass:
237.985g/mol
Topological Polar Surface Area:
67.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
170
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


5-(4-Bromophenyl)-4H-1,2,4-triazol-3-amine is a versatile compound commonly used in chemical synthesis as a building block for the creation of various organic molecules. Its unique structure and reactivity make it a valuable tool in the field of medicinal chemistry, agrochemicals, and material science. With its ability to undergo selective functionalization reactions, this compound serves as a key intermediate in the synthesis of pharmaceuticals, pesticides, and other biologically active compounds. Furthermore, its presence in diverse research applications highlights its significance in advancing the frontiers of synthetic organic chemistry.