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


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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