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Home > Fluorides > 886062-26-6
886062-26-6 | 9H-Fluoren-9-one, 2-(1-oxooctadecyl)-
CAS No: 886062-26-6 Catalog No: AG004AUW MDL No:
Product Description
Catalog Number:
AG004AUW
Chemical Name:
9H-Fluoren-9-one, 2-(1-oxooctadecyl)-
CAS Number:
886062-26-6
Molecular Formula:
C31H42O2
Molecular Weight:
446.6640
IUPAC Name:
2-octadecanoylfluoren-9-one
InChI:
InChI=1S/C31H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-30(32)25-22-23-27-26-19-17-18-20-28(26)31(33)29(27)24-25/h17-20,22-24H,2-16,21H2,1H3
InChI Key:
OSXDODGXTAUXMC-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC(=O)c1ccc2c(c1)C(=O)c1c2cccc1
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
446.318g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
446.675g/mol
Monoisotopic Mass:
446.318g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
11.7
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