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Home > Indoles and Oxindole > 72726-02-4
72726-02-4 | 2H-Isoindole-4,7-dione, 2,5-dimethyl-1,3-diphenyl-
CAS No: 72726-02-4 Catalog No: AG005PT5 MDL No:
Product Description
Catalog Number:
AG005PT5
Chemical Name:
2H-Isoindole-4,7-dione, 2,5-dimethyl-1,3-diphenyl-
CAS Number:
72726-02-4
Molecular Formula:
C22H17NO2
Molecular Weight:
327.3759
IUPAC Name:
2,5-dimethyl-1,3-diphenylisoindole-4,7-dione
InChI:
InChI=1S/C22H17NO2/c1-14-13-17(24)18-19(22(14)25)21(16-11-7-4-8-12-16)23(2)20(18)15-9-5-3-6-10-15/h3-13H,1-2H3
InChI Key:
LSTMFHPXDJPZOA-UHFFFAOYSA-N
SMILES:
CC1=CC(=O)c2c(C1=O)c(c1ccccc1)n(c2c1ccccc1)C
Properties
Complexity:
569
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.126g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.383g/mol
Monoisotopic Mass:
327.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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