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25083-69-6 | 1H-Indene-1,3(2H)-dione, 2-[1-(phenylamino)ethylidene]-
CAS No: 25083-69-6 Catalog No: AG002QG4 MDL No:
Product Description
Catalog Number:
AG002QG4
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-[1-(phenylamino)ethylidene]-
CAS Number:
25083-69-6
Molecular Formula:
C17H13NO2
Molecular Weight:
263.2906
IUPAC Name:
3-hydroxy-2-(C-methyl-N-phenylcarbonimidoyl)inden-1-one
InChI:
InChI=1S/C17H13NO2/c1-11(18-12-7-3-2-4-8-12)15-16(19)13-9-5-6-10-14(13)17(15)20/h2-10,19H,1H3
InChI Key:
IEGGAERFEYQCSV-UHFFFAOYSA-N
SMILES:
CC(=C1C(=O)c2c(C1=O)cccc2)Nc1ccccc1
Properties
Complexity:
458
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.095g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.296g/mol
Monoisotopic Mass:
263.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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