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1190321-69-7 | 6H-Pyrrolo[2,3-b]pyridin-6-one, 5-chloro-1,7-dihydro-
CAS No: 1190321-69-7 Catalog No: AG000HZQ MDL No:
Product Description
Catalog Number:
AG000HZQ
Chemical Name:
6H-Pyrrolo[2,3-b]pyridin-6-one, 5-chloro-1,7-dihydro-
CAS Number:
1190321-69-7
Molecular Formula:
C7H5ClN2O
Molecular Weight:
168.5804
IUPAC Name:
5-chloro-1,7-dihydropyrrolo[2,3-b]pyridin-6-one
InChI:
InChI=1S/C7H5ClN2O/c8-5-3-4-1-2-9-6(4)10-7(5)11/h1-3H,(H2,9,10,11)
InChI Key:
IPOFWBHQWOFZAH-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2[nH]ccc2cc1Cl
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
168.58g/mol
Monoisotopic Mass:
168.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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