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2-Bromo-9-fluorenone

CAT: 0013-GTR19254148-02Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19254148-02Size:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
2-Bromo-9-fluorenone, with CAS No. 3096-56-8, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. 2-Bromo-9-fluorenone provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
3096-56-8
Product Name Alternative
2Bromo9fluorenone, 2 Bromo 9 fluorenone
Purity
99.94% (May vary between batches)
Smiles
BrC1=CC2=C (C=C1) C1=CC=CC=C1C2=O
Molecular Formula
C13H7BrO
Molecular Weight
259.102
Storage Conditions
Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

2-Bromo-9-fluorenone
CAS Number3096-56-8
PubChem CID725831
IUPAC Name2-bromofluoren-9-one
Molecular FormulaC13H7BrO
Molecular Weight259.10
XLogP4.3
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count15
Formal Charge0
Complexity276
SMILES
C1=CC=C2C(=C1)C3=C(C2=O)C=C(C=C3)Br
InChI
InChI=1S/C13H7BrO/c14-8-5-6-10-9-3-1-2-4-11(9)13(15)12(10)7-8/h1-7H
InChIKey
MTCARZDHUIEYMB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Bromo-9-fluorenone
CAS: 3096-56-8
CID: 725831
Formula: C13H7BrO
MW: 259.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight259.10
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass257.96803
Monoisotopic Mass257.96803
Topological Polar Surface Area17.1 Ų
Heavy Atom Count15
Formal Charge0
Complexity276
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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