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262353-38-8 | 2-Pyrimidinecarboxylic acid, 4-methoxy-, ethyl ester
CAS No: 262353-38-8 Catalog No: AG002SDR MDL No:
Product Description
Catalog Number:
AG002SDR
Chemical Name:
2-Pyrimidinecarboxylic acid, 4-methoxy-, ethyl ester
CAS Number:
262353-38-8
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
IUPAC Name:
ethyl 4-methoxypyrimidine-2-carboxylate
InChI:
InChI=1S/C8H10N2O3/c1-3-13-8(11)7-9-5-4-6(10-7)12-2/h4-5H,3H2,1-2H3
InChI Key:
GLKJUFAIHBRDAS-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nccc(n1)OC
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.179g/mol
Monoisotopic Mass:
182.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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