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2046-74-4 | 6-Pteridinecarboxylic acid, 7,8-dihydro-2-methoxy-8-methyl-7-oxo-, ethyl ester
CAS No: 2046-74-4 Catalog No: AG0029MC MDL No:
Product Description
Catalog Number:
AG0029MC
Chemical Name:
6-Pteridinecarboxylic acid, 7,8-dihydro-2-methoxy-8-methyl-7-oxo-, ethyl ester
CAS Number:
2046-74-4
Molecular Formula:
C11H12N4O4
Molecular Weight:
264.2374
IUPAC Name:
ethyl 2-methoxy-8-methyl-7-oxopteridine-6-carboxylate
InChI:
InChI=1S/C11H12N4O4/c1-4-19-10(17)7-9(16)15(2)8-6(13-7)5-12-11(14-8)18-3/h5H,4H2,1-3H3
InChI Key:
FQCQKLQQYBSFHN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc2cnc(nc2n(c1=O)C)OC
NSC Number:
73519
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.086g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.241g/mol
Monoisotopic Mass:
264.086g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
94A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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