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Home > Fluorides > 133053-02-8
133053-02-8 | 1H-Pyrrole-2,5-dione, 3,4-bis(5-fluoro-1H-indol-3-yl)-
CAS No: 133053-02-8 Catalog No: AG0011LA MDL No:
Product Description
Catalog Number:
AG0011LA
Chemical Name:
1H-Pyrrole-2,5-dione, 3,4-bis(5-fluoro-1H-indol-3-yl)-
CAS Number:
133053-02-8
Molecular Formula:
C20H11F2N3O2
Molecular Weight:
363.3170
IUPAC Name:
3,4-bis(5-fluoro-1H-indol-3-yl)pyrrole-2,5-dione
InChI:
InChI=1S/C20H11F2N3O2/c21-9-1-3-15-11(5-9)13(7-23-15)17-18(20(27)25-19(17)26)14-8-24-16-4-2-10(22)6-12(14)16/h1-8,23-24H,(H,25,26,27)
InChI Key:
HNJSJBRNWKPVQR-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C(=C1c1c[nH]c2c1cc(F)cc2)c1c[nH]c2c1cc(F)cc2
Properties
Complexity:
641
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.082g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
363.324g/mol
Monoisotopic Mass:
363.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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