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Home > Aldehydes > 728034-12-6
728034-12-6 | 1H-Pyrrolo[2,3-b]pyridine-4-carbaldehyde
CAS No: 728034-12-6 Catalog No: AG005P0P MDL No:MFCD08272237
Product Description
Catalog Number:
AG005P0P
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-4-carbaldehyde
CAS Number:
728034-12-6
Molecular Formula:
C8H6N2O
Molecular Weight:
146.1460
MDL Number:
MFCD08272237
IUPAC Name:
1H-pyrrolo[2,3-b]pyridine-4-carbaldehyde
InChI:
InChI=1S/C8H6N2O/c11-5-6-1-3-9-8-7(6)2-4-10-8/h1-5H,(H,9,10)
InChI Key:
IEPOMBHPYZJZNR-UHFFFAOYSA-N
SMILES:
O=Cc1ccnc2c1cc[nH]2
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.149g/mol
Monoisotopic Mass:
146.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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