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4770-70-1 | 3-(1-Oxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid
CAS No: 4770-70-1 Catalog No: AG01FGL9 MDL No:
Product Description
Catalog Number:
AG01FGL9
Chemical Name:
3-(1-Oxo-1,3-dihydro-2H-isoindol-2-yl)benzoic acid
CAS Number:
4770-70-1
IUPAC Name:
3-(3-oxo-1H-isoindol-2-yl)benzoic acid
InChI:
InChI=1S/C15H11NO3/c17-14-13-7-2-1-4-11(13)9-16(14)12-6-3-5-10(8-12)15(18)19/h1-8H,9H2,(H,18,19)
InChI Key:
RLIXOQAKBDGAOW-UHFFFAOYSA-N
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.074g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.257g/mol
Monoisotopic Mass:
253.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| 2-, 3-, and 4-(1-Oxo-1H-2,3-dihydroisoindol-2-yl)benzoic acids and their corresponding organotin carboxylates: synthesis, characterization, fluorescent, and biological activities. | Bioorganic & medicinal chemistry letters 20101001 |
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