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953742-74-0 | 1H-Pyrrolo[2,3-f]quinoline-2,3-dione
CAS No: 953742-74-0 Catalog No: AG006598 MDL No:
Product Description
Catalog Number:
AG006598
Chemical Name:
1H-Pyrrolo[2,3-f]quinoline-2,3-dione
CAS Number:
953742-74-0
Molecular Formula:
C11H6N2O2
Molecular Weight:
198.1775
IUPAC Name:
1H-pyrrolo[2,3-f]quinoline-2,3-dione
InChI:
InChI=1S/C11H6N2O2/c14-10-7-3-4-8-6(2-1-5-12-8)9(7)13-11(10)15/h1-5H,(H,13,14,15)
InChI Key:
HLRRUXIELIKVDG-UHFFFAOYSA-N
SMILES:
O=C1C(=O)Nc2c1ccc1c2cccn1
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.043g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.181g/mol
Monoisotopic Mass:
198.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
59.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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