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400037-42-5 | 3-(2-Phenyl-imidazo[1,2-a]pyridin-3-yl)-acrylic acid
CAS No: 400037-42-5 Catalog No: AG01EVSX MDL No:
Product Description
Catalog Number:
AG01EVSX
Chemical Name:
3-(2-Phenyl-imidazo[1,2-a]pyridin-3-yl)-acrylic acid
CAS Number:
400037-42-5
Molecular Formula:
C16H12N2O2
Molecular Weight:
264.2787
IUPAC Name:
3-(2-phenylimidazo[1,2-a]pyridin-3-yl)prop-2-enoic acid
InChI:
InChI=1S/C16H12N2O2/c19-15(20)10-9-13-16(12-6-2-1-3-7-12)17-14-8-4-5-11-18(13)14/h1-11H,(H,19,20)
InChI Key:
RUBYIZKMLSFLLU-UHFFFAOYSA-N
SMILES:
OC(=O)/C=C/c1c(nc2n1cccc2)c1ccccc1
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.09g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.284g/mol
Monoisotopic Mass:
264.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.4
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