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102077-60-1 | 9,10-Anthracenedione, 2-methyl-1-(3-methyl-2-buten-1-yl)-
CAS No: 102077-60-1 Catalog No: AG0006L1 MDL No:
Product Description
Catalog Number:
AG0006L1
Chemical Name:
9,10-Anthracenedione, 2-methyl-1-(3-methyl-2-buten-1-yl)-
CAS Number:
102077-60-1
Molecular Formula:
C20H18O2
Molecular Weight:
290.3557
IUPAC Name:
2-methyl-1-(3-methylbut-2-enyl)anthracene-9,10-dione
InChI:
InChI=1S/C20H18O2/c1-12(2)8-10-14-13(3)9-11-17-18(14)20(22)16-7-5-4-6-15(16)19(17)21/h4-9,11H,10H2,1-3H3
InChI Key:
LHDZOZCZOHZIOV-UHFFFAOYSA-N
SMILES:
CC(=CCc1c(C)ccc2c1C(=O)c1ccccc1C2=O)C
Properties
Complexity:
486
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.131g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.362g/mol
Monoisotopic Mass:
290.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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