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89115-88-8 | 9(10H)-Anthracenone, 4-(1-methylethyl)-
CAS No: 89115-88-8 Catalog No: AG003YZJ MDL No:
Product Description
Catalog Number:
AG003YZJ
Chemical Name:
9(10H)-Anthracenone, 4-(1-methylethyl)-
CAS Number:
89115-88-8
Molecular Formula:
C17H16O
Molecular Weight:
236.3083
IUPAC Name:
4-propan-2-yl-10H-anthracen-9-one
InChI:
InChI=1S/C17H16O/c1-11(2)13-8-5-9-15-16(13)10-12-6-3-4-7-14(12)17(15)18/h3-9,11H,10H2,1-2H3
InChI Key:
FGWUYWBHPINAJO-UHFFFAOYSA-N
SMILES:
CC(c1cccc2c1Cc1ccccc1C2=O)C
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.12g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.314g/mol
Monoisotopic Mass:
236.12g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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