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17533-69-6 | 1H-Indene-1,3(2H)-dione, 2-(2,3,4,5,6-pentamethylphenyl)-
CAS No: 17533-69-6 Catalog No: AG0020XE MDL No:
Product Description
Catalog Number:
AG0020XE
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-(2,3,4,5,6-pentamethylphenyl)-
CAS Number:
17533-69-6
Molecular Formula:
C20H20O2
Molecular Weight:
292.3716
IUPAC Name:
2-(2,3,4,5,6-pentamethylphenyl)indene-1,3-dione
InChI:
InChI=1S/C20H20O2/c1-10-11(2)13(4)17(14(5)12(10)3)18-19(21)15-8-6-7-9-16(15)20(18)22/h6-9,18H,1-5H3
InChI Key:
IWSKRZXBKWPCOY-UHFFFAOYSA-N
SMILES:
O=C1C(C(=O)c2c1cccc2)c1c(C)c(C)c(c(c1C)C)C
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.146g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.378g/mol
Monoisotopic Mass:
292.146g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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