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2,5-Dibromohydroquinone

CAT: 0127-OR30490-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-OR30490-01Size:5 g
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CAS Number
14753-51-6
MDL Number
MFCD00192664
Purity
98%
Smiles
Oc1cc(Br)c(O)cc1Br

Chemical Information

2,5-Dibromohydroquinone
CAS Number14753-51-6
PubChem CID280945
IUPAC Name2,5-dibromobenzene-1,4-diol
Molecular FormulaC6H4Br2O2
Molecular Weight267.90
XLogP2.6
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count10
Formal Charge0
Complexity106
SMILES
C1=C(C(=CC(=C1Br)O)Br)O
InChI
InChI=1S/C6H4Br2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2,9-10H
InChIKey
VALXCIRMSIFPFN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Dibromohydroquinone
CAS: 14753-51-6
CID: 280945
Formula: C6H4Br2O2
MW: 267.90
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight267.90
XLogP32.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass267.85576
Monoisotopic Mass265.85780
Topological Polar Surface Area40.5 Ų
Heavy Atom Count10
Formal Charge0
Complexity106
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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