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139123-56-1 | 2,3-Pyridinedicarboxylic acid, 5-(methoxymethyl)-, 2,3-dimethyl ester
CAS No: 139123-56-1 Catalog No: AG001ACH MDL No:
Product Description
Catalog Number:
AG001ACH
Chemical Name:
2,3-Pyridinedicarboxylic acid, 5-(methoxymethyl)-, 2,3-dimethyl ester
CAS Number:
139123-56-1
Molecular Formula:
C11H13NO5
Molecular Weight:
239.2246
IUPAC Name:
dimethyl 5-(methoxymethyl)pyridine-2,3-dicarboxylate
InChI:
InChI=1S/C11H13NO5/c1-15-6-7-4-8(10(13)16-2)9(12-5-7)11(14)17-3/h4-5H,6H2,1-3H3
InChI Key:
ZCDHDTQWOJRFFE-UHFFFAOYSA-N
SMILES:
COCc1cnc(c(c1)C(=O)OC)C(=O)OC
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.227g/mol
Monoisotopic Mass:
239.079g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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