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Home > Aldehydes > 1190319-00-6
1190319-00-6 | 1H-Pyrrolo[3,2-b]pyridine-3-carboxaldehyde, 7-hydroxy-
CAS No: 1190319-00-6 Catalog No: AG000HU7 MDL No:
Product Description
Catalog Number:
AG000HU7
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine-3-carboxaldehyde, 7-hydroxy-
CAS Number:
1190319-00-6
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.1454
IUPAC Name:
7-oxo-1,4-dihydropyrrolo[3,2-b]pyridine-3-carbaldehyde
InChI:
InChI=1S/C8H6N2O2/c11-4-5-3-10-8-6(12)1-2-9-7(5)8/h1-4,10H,(H,9,12)
InChI Key:
KWHVOCDQMDDHQN-UHFFFAOYSA-N
SMILES:
Oc1ccnc2c1[nH]cc2C=O
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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