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2-Bromo-1-iodonaphthalene

CAT: 1266-JH913463Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1266-JH913463Size:1 Each
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CAS Number
676267-05-3
Molecular Formula
C10H6BrI
Molecular Weight
332.96

Chemical Information

2-Bromo-1-iodonaphthalene
CAS Number676267-05-3
PubChem CID24179924
IUPAC Name2-bromo-1-iodonaphthalene
Molecular FormulaC10H6BrI
Molecular Weight332.96
XLogP4.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count12
Formal Charge0
Complexity160
SMILES
C1=CC=C2C(=C1)C=CC(=C2I)Br
InChI
InChI=1S/C10H6BrI/c11-9-6-5-7-3-1-2-4-8(7)10(9)12/h1-6H
InChIKey
QAFFBUBNQSNVSZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Bromo-1-iodonaphthalene
CAS: 676267-05-3
CID: 24179924
Formula: C10H6BrI
MW: 332.96
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight332.96
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass331.86976
Monoisotopic Mass331.86976
Topological Polar Surface Area0 Ų
Heavy Atom Count12
Formal Charge0
Complexity160
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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