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Home > Indoles and Oxindole > 88683-45-8
88683-45-8 | 1H-Isoindole-1,3(2H)-dione, 2-[(4-methoxyphenyl)thio]-
CAS No: 88683-45-8 Catalog No: AG0047FW MDL No:
Product Description
Catalog Number:
AG0047FW
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-[(4-methoxyphenyl)thio]-
CAS Number:
88683-45-8
Molecular Formula:
C15H11NO3S
Molecular Weight:
285.3177
IUPAC Name:
2-(4-methoxyphenyl)sulfanylisoindole-1,3-dione
InChI:
InChI=1S/C15H11NO3S/c1-19-10-6-8-11(9-7-10)20-16-14(17)12-4-2-3-5-13(12)15(16)18/h2-9H,1H3
InChI Key:
YVWDSIMDUBBQIW-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)SN1C(=O)c2c(C1=O)cccc2
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.046g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.317g/mol
Monoisotopic Mass:
285.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
71.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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