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1190318-81-0 | 2H-Pyrrolo[2,3-b]pyridin-2-one, 4,6-difluoro-1,3-dihydro-
CAS No: 1190318-81-0 Catalog No: AG000HTE MDL No:
Product Description
Catalog Number:
AG000HTE
Chemical Name:
2H-Pyrrolo[2,3-b]pyridin-2-one, 4,6-difluoro-1,3-dihydro-
CAS Number:
1190318-81-0
Molecular Formula:
C7H4F2N2O
Molecular Weight:
170.1163
IUPAC Name:
4,6-difluoro-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
InChI:
InChI=1S/C7H4F2N2O/c8-4-2-5(9)10-7-3(4)1-6(12)11-7/h2H,1H2,(H,10,11,12)
InChI Key:
BGCORRRAQIFWQB-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1)c(F)cc(n2)F
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.119g/mol
Monoisotopic Mass:
170.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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