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128276-49-3 | 2-Pyrimidinecarboxylic acid, 4,6-dimethoxy-, ethyl ester
CAS No: 128276-49-3 Catalog No: AG000XXT MDL No:MFCD03645366
Product Description
Catalog Number:
AG000XXT
Chemical Name:
2-Pyrimidinecarboxylic acid, 4,6-dimethoxy-, ethyl ester
CAS Number:
128276-49-3
Molecular Formula:
C9H12N2O4
Molecular Weight:
212.2026
MDL Number:
MFCD03645366
IUPAC Name:
ethyl 4,6-dimethoxypyrimidine-2-carboxylate
InChI:
InChI=1S/C9H12N2O4/c1-4-15-9(12)8-10-6(13-2)5-7(11-8)14-3/h5H,4H2,1-3H3
InChI Key:
ODMOQVSDVCHMLF-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc(OC)cc(n1)OC
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.08g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.205g/mol
Monoisotopic Mass:
212.08g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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