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Home > Aldehydes > 921620-80-6
921620-80-6 | 5H-Pyrrolo[2,1-a]isoindole-9-carboxaldehyde, 5-oxo-
CAS No: 921620-80-6 Catalog No: AG006HAH MDL No:
Product Description
Catalog Number:
AG006HAH
Chemical Name:
5H-Pyrrolo[2,1-a]isoindole-9-carboxaldehyde, 5-oxo-
CAS Number:
921620-80-6
Molecular Formula:
C12H7NO2
Molecular Weight:
197.1895
IUPAC Name:
5-oxopyrrolo[2,1-a]isoindole-9-carbaldehyde
InChI:
InChI=1S/C12H7NO2/c14-7-8-3-1-4-9-11(8)10-5-2-6-13(10)12(9)15/h1-7H
InChI Key:
DXJHYNHMYGJTHY-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1c1cccn1C2=O
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.048g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.193g/mol
Monoisotopic Mass:
197.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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