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  2. 5-O-tert-butyl 3-O-ethyl 4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole-3,5-dicarboxylate

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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)-

5-O-tert-butyl 3-O-ethyl 4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole-3,5-dicarboxylate

CCOC(=O)c1n[nH]c2c1CN(C2)C(=O)OC(C)(C)C Request for Quotation
Chemical Name: 5-O-tert-butyl 3-O-ethyl 4,6-dihydro-1H-pyrrolo[3,4-c]pyrazole-3,5-dicarboxylate
CAS Number: 1026853-23-5
Product Number: AG00083R(AGN-PC-0N3HBL)
Synonyms:
MDL No:
Molecular Formula: C13H19N3O4
Molecular Weight: 281.3077

Identification/Properties

Computed Properties
Molecular Weight:
281.312g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
5
Exact Mass:
281.138g/mol
Monoisotopic Mass:
281.138g/mol
Topological Polar Surface Area:
84.5A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
394
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-H317
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


The 5-tert-Butyl 3-ethyl 4,6-dihydropyrrolo[3,4-c]pyrazole-3,5(1H)-dicarboxylate is a versatile compound that finds key applications in chemical synthesis. This molecule serves as an important building block for the creation of various organic compounds due to its unique structural features and reactivity.In chemical synthesis, this compound plays a crucial role as a precursor in the construction of complex molecules. Its substituted pyrrole and pyrazole rings provide specific sites for further functionalization, allowing chemists to modify the molecule in a controlled manner to achieve desired chemical properties.The presence of both ester and carboxylate groups in the molecule offers opportunities for diverse chemical transformations, such as esterification, amidation, and condensation reactions. These reactions enable the synthesis of novel compounds with tailored structures and functionalities for a range of applications in medicinal chemistry, materials science, and agrochemicals.Overall, the 5-tert-Butyl 3-ethyl 4,6-dihydropyrrolo[3,4-c]pyrazole-3,5(1H)-dicarboxylate serves as a valuable intermediate in chemical synthesis, facilitating the creation of intricate organic molecules with potential applications across various industries.