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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-carboxylic acid, 5-(2-methylpropyl)-

CC(Cc1[nH]nc(c1)C(=O)O)C Request for Quotation
Chemical Name: 1H-Pyrazole-3-carboxylic acid, 5-(2-methylpropyl)-
CAS Number: 92933-49-8
Product Number: AG00IHE9(AGN-PC-0JUFF6)
Synonyms:
MDL No:
Molecular Formula: C8H12N2O2
Molecular Weight: 168.19308

Identification/Properties

Properties
BP:
376.2°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
168.196g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
168.09g/mol
Monoisotopic Mass:
168.09g/mol
Topological Polar Surface Area:
66A^2
Heavy Atom Count:
12
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

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


5-Isobutyl-1H-pyrazole-3-carboxylic acid is a versatile compound that finds extensive application in chemical synthesis due to its unique structural properties. As a key intermediate in organic reactions, this compound serves as a building block for the synthesis of various bioactive molecules, pharmaceuticals, and agrochemicals. Its functional groups enable it to participate in a wide range of chemical transformations, making it a valuable tool for organic chemists. Additionally, the presence of the isobutyl group enhances the compound's stability and leads to improved reactivity in diverse synthetic pathways. Overall, 5-Isobutyl-1H-pyrazole-3-carboxylic acid plays a crucial role in the construction of complex organic molecules and offers exciting opportunities for innovative chemical synthesis strategies.