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1190314-80-7 | 2H-Pyrrolo[2,3-b]pyridin-2-one, 6-chloro-1,3-dihydro-4-hydroxy-
CAS No: 1190314-80-7 Catalog No: AG000HNA MDL No:
Product Description
Catalog Number:
AG000HNA
Chemical Name:
2H-Pyrrolo[2,3-b]pyridin-2-one, 6-chloro-1,3-dihydro-4-hydroxy-
CAS Number:
1190314-80-7
Molecular Formula:
C7H5ClN2O2
Molecular Weight:
184.5798
IUPAC Name:
6-chloro-3,7-dihydro-1H-pyrrolo[2,3-b]pyridine-2,4-dione
InChI:
InChI=1S/C7H5ClN2O2/c8-5-2-4(11)3-1-6(12)10-7(3)9-5/h2H,1H2,(H2,9,10,11,12)
InChI Key:
WNVRJDHSHQTUOW-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)c(O)cc(n2)Cl
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.004g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
184.579g/mol
Monoisotopic Mass:
184.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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