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1221153-84-9 | Ethanone, 1-[1-(1-methylethyl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-
CAS No: 1221153-84-9 Catalog No: AG0016S5 MDL No:MFCD22571324
Product Description
Catalog Number:
AG0016S5
Chemical Name:
Ethanone, 1-[1-(1-methylethyl)-1H-pyrrolo[2,3-c]pyridin-3-yl]-
CAS Number:
1221153-84-9
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
MDL Number:
MFCD22571324
IUPAC Name:
1-(1-propan-2-ylpyrrolo[2,3-c]pyridin-3-yl)ethanone
InChI:
InChI=1S/C12H14N2O/c1-8(2)14-7-11(9(3)15)10-4-5-13-6-12(10)14/h4-8H,1-3H3
InChI Key:
JRXMCKDWYVVJMJ-UHFFFAOYSA-N
SMILES:
CC(=O)c1cn(c2c1ccnc2)C(C)C
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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