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Home > Aldehydes > 1190314-66-9
1190314-66-9 | 1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 4-hydroxy-
CAS No: 1190314-66-9 Catalog No: AG000HM4 MDL No:MFCD12962710
Product Description
Catalog Number:
AG000HM4
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 4-hydroxy-
CAS Number:
1190314-66-9
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.1454
MDL Number:
MFCD12962710
IUPAC Name:
4-oxo-1,7-dihydropyrrolo[2,3-b]pyridine-3-carbaldehyde
InChI:
InChI=1S/C8H6N2O2/c11-4-5-3-10-8-7(5)6(12)1-2-9-8/h1-4H,(H2,9,10,12)
InChI Key:
OCFFEPKNSVAYCL-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c2c1c(O)ccn2
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
162.148g/mol
Monoisotopic Mass:
162.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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