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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-Pyrazole, 3-phenyl-

c1ccc(cc1)c1n[nH]cc1 Request for Quotation
Chemical Name: 1H-Pyrazole, 3-phenyl-
CAS Number: 2458-26-6
Product Number: AG00BC38(AGN-PC-0O87CU)
Synonyms:
MDL No:
Molecular Formula: C9H8N2
Molecular Weight: 144.1732

Identification/Properties

Properties
MP:
75-77 °C
BP:
339.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5960 (estimate)
Computed Properties
Molecular Weight:
144.177g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
144.069g/mol
Monoisotopic Mass:
144.069g/mol
Topological Polar Surface Area:
28.7A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
119
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+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


The 1H-Pyrazole, 3-phenyl- compound plays a crucial role in chemical synthesis as a versatile building block that offers a wide range of applications. It serves as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and functional materials. Its unique chemical structure and reactivity allow for the introduction of different functional groups, enabling the development of diverse organic compounds. In addition, 1H-Pyrazole, 3-phenyl- is utilized in the preparation of heterocyclic compounds, which are essential in drug discovery and development. Its presence in the chemical synthesis toolbox provides chemists with a valuable tool for creating novel molecules with potentially beneficial properties.