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114007-58-8 | Pyrazolo[1,5-a]pyridine-2-acetic acid, 3-(ethoxycarbonyl)-
CAS No: 114007-58-8 Catalog No: AG000AAU MDL No:
Product Description
Catalog Number:
AG000AAU
Chemical Name:
Pyrazolo[1,5-a]pyridine-2-acetic acid, 3-(ethoxycarbonyl)-
CAS Number:
114007-58-8
Molecular Formula:
C12H12N2O4
Molecular Weight:
248.2347
IUPAC Name:
2-(3-ethoxycarbonylpyrazolo[1,5-a]pyridin-2-yl)acetic acid
InChI:
InChI=1S/C12H12N2O4/c1-2-18-12(17)11-8(7-10(15)16)13-14-6-4-3-5-9(11)14/h3-6H,2,7H2,1H3,(H,15,16)
InChI Key:
FPABWZAZGRIDIQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(CC(=O)O)nn2c1cccc2
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.08g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.238g/mol
Monoisotopic Mass:
248.08g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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