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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)-

1-[(3-chlorophenyl)methyl]-1,2,4-triazol-3-amine

Clc1cccc(c1)Cn1cnc(n1)N Request for Quotation
Chemical Name: 1-[(3-chlorophenyl)methyl]-1,2,4-triazol-3-amine
CAS Number: 832739-72-7
Product Number: AG00G9RM(AGN-PC-0LW8JV)
Synonyms:
MDL No:
Molecular Formula: C9H9ClN4
Molecular Weight: 208.6476

Identification/Properties

Computed Properties
Molecular Weight:
208.649g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
208.052g/mol
Monoisotopic Mass:
208.052g/mol
Topological Polar Surface Area:
56.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
190
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P264-P270-P301+P312+P330-P501
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


1-(3-Chlorobenzyl)-1H-1,2,4-triazol-3-amine is a versatile compound used in chemical synthesis for its unique properties. This compound serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and specialty chemicals. Its structure allows for effective functionalization, making it a valuable intermediate in the synthesis of complex organic molecules. Additionally, its triazole ring system provides stability and reactivity that can be exploited for the development of novel compounds with enhanced biological activities. In pharmaceutical research, 1-(3-Chlorobenzyl)-1H-1,2,4-triazol-3-amine has shown promising potential as a scaffold for the design of new drug candidates targeting a wide range of therapeutic areas. Its synthesis and utilization in chemical reactions offer exciting opportunities for the advancement of drug discovery and organic chemistry.