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1,2-Bis (4-Bromophenyl) Diazene

CAT: 0127-OR1028559-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1028559-01Size:250 mg
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CAS Number
1601-98-5
Synonyms
Bis (4-bromophenyl) diazene
Purity
95%
Smiles
C1=CC(=CC=C1N=NC2=CC=C(C=C2)Br)Br

Chemical Information

4,4'-Dibromoazobenzene
CAS Number1601-98-5
PubChem CID137099
IUPAC Namebis(4-bromophenyl)diazene
Molecular FormulaC12H8Br2N2
Molecular Weight340.01
XLogP5.5
Topological Polar Surface Area24.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity205
SMILES
C1=CC(=CC=C1N=NC2=CC=C(C=C2)Br)Br
InChI
InChI=1S/C12H8Br2N2/c13-9-1-5-11(6-2-9)15-16-12-7-3-10(14)4-8-12/h1-8H
InChIKey
LTPLLZWVPBTAMH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4,4'-Dibromoazobenzene
CAS: 1601-98-5
CID: 137099
Formula: C12H8Br2N2
MW: 340.01
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight340.01
XLogP35.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass339.90337
Monoisotopic Mass337.90542
Topological Polar Surface Area24.7 Ų
Heavy Atom Count16
Formal Charge0
Complexity205
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