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119140-24-8 | 5-Pyrimidinecarboxylic acid, 2,4-dimethoxy-6-methyl-, methyl ester
CAS No: 119140-24-8 Catalog No: AG000I9L MDL No:
Product Description
Catalog Number:
AG000I9L
Chemical Name:
5-Pyrimidinecarboxylic acid, 2,4-dimethoxy-6-methyl-, methyl ester
CAS Number:
119140-24-8
Molecular Formula:
C9H12N2O4
Molecular Weight:
212.2026
IUPAC Name:
methyl 2,4-dimethoxy-6-methylpyrimidine-5-carboxylate
InChI:
InChI=1S/C9H12N2O4/c1-5-6(8(12)14-3)7(13-2)11-9(10-5)15-4/h1-4H3
InChI Key:
KITTVFUPRYITJL-UHFFFAOYSA-N
SMILES:
COc1nc(C)c(c(n1)OC)C(=O)OC
Properties
Complexity:
224
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:
4
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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