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9-Bromo-9-phenylfluorene

CAT: 1266-JH699501Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1266-JH699501Size:1 Each
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CAS Number
55135-66-5
UN Code
UN 3261
Hazard Statement
C
HS Code
321.21
Stability
Stable under normal temperatures and pressures.
Molecular Formula
9--9-
Molecular Weight
C19H13Br
Product Name Synonym
9-bromanyl-9-phenyl-fluorene
Physical Properties
Yellow Crystalline Solid
Hazardous Class
8
Safety Statements
S26-S27-S28-S36/37/39-S45
Density
1.425 g/cm3
Flash Point
172.5oC
RIDADR
UN 3261
Melting Point
99-101oC

Chemical Information

9-Bromo-9-phenylfluorene
CAS Number55135-66-5
PubChem CID231624
IUPAC Name9-bromo-9-phenylfluorene
Molecular FormulaC19H13Br
Molecular Weight321.2
XLogP5.4
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity322
SMILES
C1=CC=C(C=C1)C2(C3=CC=CC=C3C4=CC=CC=C42)Br
InChI
InChI=1S/C19H13Br/c20-19(14-8-2-1-3-9-14)17-12-6-4-10-15(17)16-11-5-7-13-18(16)19/h1-13H
InChIKey
HYQXNCDBSALQLB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 9-Bromo-9-phenylfluorene
CAS: 55135-66-5
CID: 231624
Formula: C19H13Br
MW: 321.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight321.2
XLogP35.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count1
Exact Mass320.02006
Monoisotopic Mass320.02006
Topological Polar Surface Area0 Ų
Heavy Atom Count20
Formal Charge0
Complexity322
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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