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3,5-Dibromochlorobenzene

CAT: 0127-OR4505-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-OR4505-01Size:5 g
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CAS Number
14862-52-3
Synonyms
1-Chloro-3,5-dibromobenzene
MDL Number
MFCD00070765
Purity
=95%
Smiles
Clc1cc(Br)cc(Br)c1

Chemical Information

1,3-Dibromo-5-chlorobenzene
CAS Number14862-52-3
PubChem CID84676
IUPAC Name1,3-dibromo-5-chlorobenzene
Molecular FormulaC6H3Br2Cl
Molecular Weight270.35
XLogP4.4
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity87
SMILES
C1=C(C=C(C=C1Br)Br)Cl
InChI
InChI=1S/C6H3Br2Cl/c7-4-1-5(8)3-6(9)2-4/h1-3H
InChIKey
FNKCOUREFBNNHG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,3-Dibromo-5-chlorobenzene
CAS: 14862-52-3
CID: 84676
Formula: C6H3Br2Cl
MW: 270.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight270.35
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass269.82695
Monoisotopic Mass267.82900
Topological Polar Surface Area0 Ų
Heavy Atom Count9
Formal Charge0
Complexity87.1
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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