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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)-

Benzonitrile, 5-amino-2-chloro-

N#Cc1cc(N)ccc1Cl Request for Quotation
Chemical Name: Benzonitrile, 5-amino-2-chloro-
CAS Number: 35747-58-1
Product Number: AG003MD7(AGN-PC-0NE5W8)
Synonyms:
MDL No: MFCD00800459
Molecular Formula: C7H5ClN2
Molecular Weight: 152.5810

Identification/Properties

Properties
MP:
115.5°C
BP:
339.1°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Refractive Index:
1.6100 (estimate)
Computed Properties
Molecular Weight:
152.581g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
152.014g/mol
Monoisotopic Mass:
152.014g/mol
Topological Polar Surface Area:
49.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
160
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-Amino-2-chlorobenzonitrile, also known as 5-acbm, is a versatile compound that finds widespread application in chemical synthesis, particularly in the pharmaceutical and agrochemical industries. This compound serves as a key building block for the synthesis of various biologically active molecules due to its unique chemical properties.One of the main uses of 5-amino-2-chlorobenzonitrile in chemical synthesis is as a precursor for the preparation of heterocyclic compounds, which are essential structural motifs found in many pharmaceuticals. By undergoing various transformations, such as condensation reactions or nucleophilic substitutions, 5-amino-2-chlorobenzonitrile can be converted into a wide range of heterocycles with diverse pharmacological activities.Additionally, this compound is also employed in the synthesis of dyes and pigments, where its aromatic nature and functional groups allow for facile modification and incorporation into the molecular structure of the desired colorant. The presence of the amino and cyano groups in 5-amino-2-chlorobenzonitrile provides multiple points for chemical manipulation, enabling the synthesis of a variety of dye molecules with different hues and properties.Furthermore, 5-amino-2-chlorobenzonitrile serves as a valuable intermediate in the production of herbicides and pesticides. By utilizing its reactive functional groups, chemists can introduce specific substituents to tailor the molecular structure of the final agrochemical product, enhancing its efficacy and selectivity in targeting pests or unwanted vegetation.Overall, the versatility and reactivity of 5-amino-2-chlorobenzonitrile make it a valuable compound in chemical synthesis, playing a crucial role in the development of various compounds with applications in pharmaceuticals, agrochemicals, and materials science.