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2-Acetyl-7-bromofluorene

CAT: 0127-OR1077569Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR1077569Size:1 g
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CAS Number
34172-50-4
Purity
>98.0%
Smiles
CC (=O) C1=CC2=C (C=C1) C3=C (C2) C=C (C=C3) Br

Chemical Information

2-Acetyl-7-bromofluorene
CAS Number34172-50-4
PubChem CID270675
IUPAC Name1-(7-bromo-9H-fluoren-2-yl)ethanone
Molecular FormulaC15H11BrO
Molecular Weight287.15
XLogP4.1
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity314
SMILES
CC(=O)C1=CC2=C(C=C1)C3=C(C2)C=C(C=C3)Br
InChI
InChI=1S/C15H11BrO/c1-9(17)10-2-4-14-11(6-10)7-12-8-13(16)3-5-15(12)14/h2-6,8H,7H2,1H3
InChIKey
KHWBLOWMPKTMRI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Acetyl-7-bromofluorene
CAS: 34172-50-4
CID: 270675
Formula: C15H11BrO
MW: 287.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight287.15
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass285.99933
Monoisotopic Mass285.99933
Topological Polar Surface Area17.1 Ų
Heavy Atom Count17
Formal Charge0
Complexity314
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

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