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20600-72-0

20600-72-0 | 9,10-Anthracenedione, 1-(2-methylphenyl)-

CAS No: 20600-72-0 Catalog No: AG002AGH MDL No:

Product Description

Catalog Number:
AG002AGH
Chemical Name:
9,10-Anthracenedione, 1-(2-methylphenyl)-
CAS Number:
20600-72-0
Molecular Formula:
C21H14O2
Molecular Weight:
298.3347
IUPAC Name:
1-(2-methylphenyl)anthracene-9,10-dione
InChI:
InChI=1S/C21H14O2/c1-13-7-2-3-8-14(13)15-11-6-12-18-19(15)21(23)17-10-5-4-9-16(17)20(18)22/h2-12H,1H3
InChI Key:
HQFYEFYEKUSUAT-UHFFFAOYSA-N
SMILES:
Cc1ccccc1c1cccc2c1C(=O)c1ccccc1C2=O

Properties

Complexity:
482  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.099g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.341g/mol
Monoisotopic Mass:
298.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  

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