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Home > Indoles and Oxindole > 91753-05-8
91753-05-8 | 1H-Isoindole-1,3(2H)-dione, 5,5'-thiobis[2-methyl-
CAS No: 91753-05-8 Catalog No: AG006DQ5 MDL No:
Product Description
Catalog Number:
AG006DQ5
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 5,5'-thiobis[2-methyl-
CAS Number:
91753-05-8
Molecular Formula:
C18H12N2O4S
Molecular Weight:
352.3639
IUPAC Name:
2-methyl-5-(2-methyl-1,3-dioxoisoindol-5-yl)sulfanylisoindole-1,3-dione
InChI:
InChI=1S/C18H12N2O4S/c1-19-15(21)11-5-3-9(7-13(11)17(19)23)25-10-4-6-12-14(8-10)18(24)20(2)16(12)22/h3-8H,1-2H3
InChI Key:
ULWVBNZUSDIXNG-UHFFFAOYSA-N
SMILES:
CN1C(=O)c2c(C1=O)cc(cc2)Sc1ccc2c(c1)C(=O)N(C2=O)C
Properties
Complexity:
597
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.052g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.364g/mol
Monoisotopic Mass:
352.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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