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Home > Indoles and Oxindole > 91713-63-2
91713-63-2 | 6-BENZOYLOXINDOLE
CAS No: 91713-63-2 Catalog No: AG00H50E MDL No:MFCD09033100
Product Description
Catalog Number:
AG00H50E
Chemical Name:
6-BENZOYLOXINDOLE
CAS Number:
91713-63-2
Molecular Formula:
C15H11NO2
Molecular Weight:
237.2533
MDL Number:
MFCD09033100
IUPAC Name:
6-benzoyl-1,3-dihydroindol-2-one
InChI:
InChI=1S/C15H11NO2/c17-14-9-11-6-7-12(8-13(11)16-14)15(18)10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)
InChI Key:
AYJLPUOIDQSOLH-UHFFFAOYSA-N
SMILES:
O=C1Cc2c(N1)cc(cc2)C(=O)c1ccccc1
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.079g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.258g/mol
Monoisotopic Mass:
237.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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