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1190321-89-1 | 2H-Pyrrolo[2,3-b]pyridin-2-one, 1,3-dihydro-4-iodo-
CAS No: 1190321-89-1 Catalog No: AG000I0K MDL No:MFCD12962680
Product Description
Catalog Number:
AG000I0K
Chemical Name:
2H-Pyrrolo[2,3-b]pyridin-2-one, 1,3-dihydro-4-iodo-
CAS Number:
1190321-89-1
Molecular Formula:
C7H5IN2O
Molecular Weight:
260.0319
MDL Number:
MFCD12962680
IUPAC Name:
4-iodo-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
InChI:
InChI=1S/C7H5IN2O/c8-5-1-2-9-7-4(5)3-6(11)10-7/h1-2H,3H2,(H,9,10,11)
InChI Key:
LFCYGWNRRRKZPL-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)c(I)ccn2
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.945g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.034g/mol
Monoisotopic Mass:
259.945g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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