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Home > Fluorides > 824413-74-3
824413-74-3 | 3-[2-(4-Fluoro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-acrylic acid
CAS No: 824413-74-3 Catalog No: AG01EXJW MDL No:
Product Description
Catalog Number:
AG01EXJW
Chemical Name:
3-[2-(4-Fluoro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-acrylic acid
CAS Number:
824413-74-3
Molecular Formula:
C16H11FN2O2
Molecular Weight:
282.2691
IUPAC Name:
(E)-3-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]prop-2-enoic acid
InChI:
InChI=1S/C16H11FN2O2/c17-12-6-4-11(5-7-12)16-13(8-9-15(20)21)19-10-2-1-3-14(19)18-16/h1-10H,(H,20,21)/b9-8+
InChI Key:
WUDBJLAEGOIPPA-CMDGGOBGSA-N
SMILES:
OC(=O)/C=C/c1c(nc2n1cccc2)c1ccc(cc1)F
Properties
Complexity:
407
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
282.08g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
282.274g/mol
Monoisotopic Mass:
282.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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