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54415-77-9 | 1,5-dihydro-4h-pyrrolo[3,2-c]pyridin-4-one
CAS No: 54415-77-9 Catalog No: AG003799 MDL No:MFCD09953441
Product Description
Catalog Number:
AG003799
Chemical Name:
1,5-dihydro-4h-pyrrolo[3,2-c]pyridin-4-one
CAS Number:
54415-77-9
Molecular Formula:
C7H6N2O
Molecular Weight:
134.1353
MDL Number:
MFCD09953441
IUPAC Name:
1,5-dihydropyrrolo[3,2-c]pyridin-4-one
InChI:
InChI=1S/C7H6N2O/c10-7-5-1-3-8-6(5)2-4-9-7/h1-4,8H,(H,9,10)
InChI Key:
GTNVJVBRPMQWBQ-UHFFFAOYSA-N
SMILES:
O=c1[nH]ccc2c1cc[nH]2
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.048g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
134.138g/mol
Monoisotopic Mass:
134.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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