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2,3-Dibromobenzofuran

CAT: 0127-OR1064949-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1064949-01Size:100 mg
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CAS Number
64150-61-4
MDL Number
MFCD14586276
Purity
95%
Smiles
BrC1=C(Br)OC2=CC=CC=C12

Chemical Information

2,3-Dibromobenzofuran
CAS Number64150-61-4
PubChem CID11231194
IUPAC Name2,3-dibromo-1-benzofuran
Molecular FormulaC8H4Br2O
Molecular Weight275.92
XLogP4
Topological Polar Surface Area13.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity151
SMILES
C1=CC=C2C(=C1)C(=C(O2)Br)Br
InChI
InChI=1S/C8H4Br2O/c9-7-5-3-1-2-4-6(5)11-8(7)10/h1-4H
InChIKey
JPYBOGFQEPDJRZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,3-Dibromobenzofuran
CAS: 64150-61-4
CID: 11231194
Formula: C8H4Br2O
MW: 275.92
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight275.92
XLogP34
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass275.86084
Monoisotopic Mass273.86289
Topological Polar Surface Area13.1 Ų
Heavy Atom Count11
Formal Charge0
Complexity151
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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