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Hydroquinone extrapure AR, ExiPlus, Multi-Compendial, 99%

CAT: 0565-17732-01Size: 100 gDry Ice: NoHazardous: No
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Description
Part B
CAS Number
123-31-9
UN Code
UN No.: 3077, IMCO Class No.: 9, Packing Group: III
Storage Temperature
Room Temperature

Chemical Information

Hydroquinone

Hydroquinone is a benzenediol comprising benzene core carrying two hydroxy substituents para to each other. It has a role as an antioxidant, a cofactor, a carcinogenic agent, a mouse metabolite, a human xenobiotic metabolite, an Escherichia coli metabolite and a skin lightening agent. It is a benzenediol and a member of hydroquinones.

CAS Number123-31-9
PubChem CID785
IUPAC Namebenzene-1,4-diol
Molecular FormulaC6H6O2
Molecular Weight110.11
XLogP0.6
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity54
SMILES
C1=CC(=CC=C1O)O
InChI
InChI=1S/C6H6O2/c7-5-1-2-6(8)4-3-5/h1-4,7-8H
InChIKey
QIGBRXMKCJKVMJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hydroquinone
CAS: 123-31-9
CID: 785
Formula: C6H6O2
MW: 110.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight110.11
XLogP30.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass110.036779430
Monoisotopic Mass110.036779430
Topological Polar Surface Area40.5 Ų
Heavy Atom Count8
Formal Charge0
Complexity54.9
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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