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3-Bromo-9H-fluorene

CAT: 0926-CAA03891-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-CAA03891-01Size:50 mg
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CAS Number
2038-91-7
MDL Number
MFCD09842188
Smiles
C1C2=C (C=C (C=C2) Br) C3=CC=CC=C31
Molecular Formula
C13H9Br
Molecular Weight
245.11 g/mol
Controlled
No

Chemical Information

3-bromo-9H-fluorene
CAS Number2038-91-7
PubChem CID11959045
IUPAC Name3-bromo-9H-fluorene
Molecular FormulaC13H9Br
Molecular Weight245.11
XLogP4.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity213
SMILES
C1C2=C(C=C(C=C2)Br)C3=CC=CC=C31
InChI
InChI=1S/C13H9Br/c14-11-6-5-10-7-9-3-1-2-4-12(9)13(10)8-11/h1-6,8H,7H2
InChIKey
NJJDBOFDNCZGSP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-bromo-9H-fluorene
CAS: 2038-91-7
CID: 11959045
Formula: C13H9Br
MW: 245.11
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight245.11
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass243.98876
Monoisotopic Mass243.98876
Topological Polar Surface Area0 Ų
Heavy Atom Count14
Formal Charge0
Complexity213
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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