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Home > Indoles and Oxindole > 247068-72-0
247068-72-0 | 4,7-Methano-1H-isoindole-1,3(2H)-dione, 4,7-dihydro-2-hydroxy-
CAS No: 247068-72-0 Catalog No: AG002P3T MDL No:
Product Description
Catalog Number:
AG002P3T
Chemical Name:
4,7-Methano-1H-isoindole-1,3(2H)-dione, 4,7-dihydro-2-hydroxy-
CAS Number:
247068-72-0
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
IUPAC Name:
4-hydroxy-4-azatricyclo[5.2.1.02,6]deca-2(6),8-diene-3,5-dione
InChI:
InChI=1S/C9H7NO3/c11-8-6-4-1-2-5(3-4)7(6)9(12)10(8)13/h1-2,4-5,13H,3H2
InChI Key:
OOHUPBXPWOPFRZ-UHFFFAOYSA-N
SMILES:
ON1C(=O)C2=C(C1=O)C1CC2C=C1
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.159g/mol
Monoisotopic Mass:
177.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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