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7-Fluoroindan-1-one

CAT: 0024-sc-268393Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-268393Size:1 g
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CAS Number
651735-59-0

Chemical Information

7-Fluoroindan-1-one
CAS Number651735-59-0
PubChem CID2782767
IUPAC Name7-fluoro-2,3-dihydroinden-1-one
Molecular FormulaC9H7FO
Molecular Weight150.15
XLogP1.8
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity178
SMILES
C1CC(=O)C2=C1C=CC=C2F
InChI
InChI=1S/C9H7FO/c10-7-3-1-2-6-4-5-8(11)9(6)7/h1-3H,4-5H2
InChIKey
ASSCRDJQEHFKSX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-Fluoroindan-1-one
CAS: 651735-59-0
CID: 2782767
Formula: C9H7FO
MW: 150.15
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight150.15
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass150.048093005
Monoisotopic Mass150.048093005
Topological Polar Surface Area17.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity178
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes