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Home > Pyridines > 1190311-76-2
1190311-76-2 | 1H-Pyrrolo[3,2-b]pyridine-2,5(3H,4H)-dione
CAS No: 1190311-76-2 Catalog No: AG000HI8 MDL No:
Product Description
Catalog Number:
AG000HI8
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine-2,5(3H,4H)-dione
CAS Number:
1190311-76-2
Molecular Formula:
C7H6N2O2
Molecular Weight:
150.1347
IUPAC Name:
3,4-dihydro-1H-pyrrolo[3,2-b]pyridine-2,5-dione
InChI:
InChI=1S/C7H6N2O2/c10-6-2-1-4-5(9-6)3-7(11)8-4/h1-2H,3H2,(H,8,11)(H,9,10)
InChI Key:
JZWQDIGKJIAWIM-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)[nH]c(=O)cc2
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
150.137g/mol
Monoisotopic Mass:
150.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.2
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