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Home > Pyridines > 1222533-85-8
1222533-85-8 | Ethanone, 1-(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-
CAS No: 1222533-85-8 Catalog No: AG00170I MDL No:MFCD16628244
Product Description
Catalog Number:
AG00170I
Chemical Name:
Ethanone, 1-(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-
CAS Number:
1222533-85-8
Molecular Formula:
C10H10N2O
Molecular Weight:
174.1992
MDL Number:
MFCD16628244
IUPAC Name:
1-(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone
InChI:
InChI=1S/C10H10N2O/c1-6-3-8-9(7(2)13)5-12-10(8)11-4-6/h3-5H,1-2H3,(H,11,12)
InChI Key:
VOHMNQLBIOGYAS-UHFFFAOYSA-N
SMILES:
Cc1cnc2c(c1)c(c[nH]2)C(=O)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
174.203g/mol
Monoisotopic Mass:
174.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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