Home Carboxys Dimethyl 1-methyl-1H-imidazole-4,5-dicarboxylate

Dimethyl 1-methyl-1H-imidazole-4,5-dicarboxylate

CAS No.:
42545-22-2
Catalog Number:
AG00CLDS
Molecular Formula:
C8H10N2O4
Molecular Weight:
198.1760
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$300
- +
5g
97%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00CLDS
Chemical Name:
Dimethyl 1-methyl-1H-imidazole-4,5-dicarboxylate
CAS Number:
42545-22-2
Molecular Formula:
C8H10N2O4
Molecular Weight:
198.1760
MDL Number:
MFCD00553098
IUPAC Name:
dimethyl 1-methylimidazole-4,5-dicarboxylate
InChI:
InChI=1S/C8H10N2O4/c1-10-4-9-5(7(11)13-2)6(10)8(12)14-3/h4H,1-3H3
InChI Key:
TVVHWULPVQHJLF-UHFFFAOYSA-N
SMILES:
COC(=O)c1n(C)cnc1C(=O)OC
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.064g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.178g/mol
Monoisotopic Mass:
198.064g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties