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9-Fluorenone-d8

CAT: 1266-JH918761Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1266-JH918761Size:1 Each
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CAS Number
137219-34-2
Molecular Formula
C13H8O
Molecular Weight
180.21

Chemical Information

9H-Fluorenone-D8
CAS Number137219-34-2
PubChem CID90469885
IUPAC Name1,2,3,4,5,6,7,8-octadeuteriofluoren-9-one
Molecular FormulaC13H8O
Molecular Weight188.25
XLogP3.6
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity222
SMILES
[2H]C1=C(C(=C2C(=C1[2H])C3=C(C(=C(C(=C3C2=O)[2H])[2H])[2H])[2H])[2H])[2H]
InChI
InChI=1S/C13H8O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H/i1D,2D,3D,4D,5D,6D,7D,8D
InChIKey
YLQWCDOCJODRMT-PGRXLJNUSA-N
Chemical Structure
2D Structure
2D structure of 9H-Fluorenone-D8
CAS: 137219-34-2
CID: 90469885
Formula: C13H8O
MW: 188.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight188.25
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass188.107728842
Monoisotopic Mass188.107728842
Topological Polar Surface Area17.1 Ų
Heavy Atom Count14
Formal Charge0
Complexity222
Isotope Atom Count8
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes