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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-Imidazole-4,5-dicarboxylic acid, 1-methyl-, diethyl ester

CCOC(=O)c1n(C)cnc1C(=O)OCC Request for Quotation
Chemical Name: 1H-Imidazole-4,5-dicarboxylic acid, 1-methyl-, diethyl ester
CAS Number: 1210-92-0
Product Number: AG003PF6(AGN-PC-00O980)
Synonyms:
MDL No:
Molecular Formula: C10H14N2O4
Molecular Weight: 226.2292

Identification/Properties

Properties
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
226.232g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
6
Exact Mass:
226.095g/mol
Monoisotopic Mass:
226.095g/mol
Topological Polar Surface Area:
70.4A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
270
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-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


The Diethyl 1-Methylimidazole-4,5-dicarboxylate is a valuable compound widely utilized in chemical synthesis as a key building block. As a versatile reagent, it plays a crucial role in the production of various pharmaceuticals, agrochemicals, and specialty chemicals. Its unique structure and properties make it particularly suitable for facilitating complex organic reactions, including esterifications, amidations, and cyclizations. By serving as a stable intermediate, Diethyl 1-Methylimidazole-4,5-dicarboxylate enables efficient and selective transformations, making it a valuable tool for synthetic chemists in the development of novel molecules and compounds. Its broad applicability and reliability make it an indispensable component in modern organic synthesis methodologies.