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353293-55-7 | 3-Acetoxy-2-((ethoxycarbonyl)methoxy)pyridine
CAS No: 353293-55-7 Catalog No: AG003AFT MDL No:
Product Description
Catalog Number:
AG003AFT
Chemical Name:
3-Acetoxy-2-((ethoxycarbonyl)methoxy)pyridine
CAS Number:
353293-55-7
Molecular Formula:
C11H13NO5
Molecular Weight:
239.2246
IUPAC Name:
ethyl 2-(3-acetyloxypyridin-2-yl)oxyacetate
InChI:
InChI=1S/C11H13NO5/c1-3-15-10(14)7-16-11-9(17-8(2)13)5-4-6-12-11/h4-6H,3,7H2,1-2H3
InChI Key:
TUBVGEUEVNUENP-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1ncccc1OC(=O)C
Properties
Complexity:
269
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:
7
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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