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1,8-Dihydroxyanthraquinone-d6

CAT: 1459-CS-T-89385Size: 1 EachDry Ice: NoHazardous: No
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Description
1,8-Dihydroxyanthraquinone-d6 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Anthraquinone. The product is supplied by Clearsynth under CAT No. CS-T-89385. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
1246816-27-2
Synonyms
1,8-Dihydroxyanthraquinone-d6
Molecular Formula
C 14 H 2 D 6 O 4
Molecular Weight
246.25
Additionnal Information
1,8-Dihydroxyanthraquinone-d6 is supplied with detailed characterization data compliant with regulatory guideline. 1,8-Dihydroxyanthraquinone-d6 can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Anthraquinone.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

1,8-Dihydroxyanthraquinone-d6
CAS Number1246816-27-2
PubChem CID71316217
IUPAC Name1,2,3,6,7,8-hexadeuterio-4,5-dihydroxyanthracene-9,10-dione
Molecular FormulaC14H8O4
Molecular Weight246.25
XLogP3.2
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count18
Formal Charge0
Complexity346
SMILES
[2H]C1=C(C2=C(C(=C1[2H])O)C(=O)C3=C(C2=O)C(=C(C(=C3O)[2H])[2H])[2H])[2H]
InChI
InChI=1S/C14H8O4/c15-9-5-1-3-7-11(9)14(18)12-8(13(7)17)4-2-6-10(12)16/h1-6,15-16H/i1D,2D,3D,4D,5D,6D
InChIKey
QBPFLULOKWLNNW-MZWXYZOWSA-N
Chemical Structure
2D Structure
2D structure of 1,8-Dihydroxyanthraquinone-d6
CAS: 1246816-27-2
CID: 71316217
Formula: C14H8O4
MW: 246.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight246.25
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass246.07991921
Monoisotopic Mass246.07991921
Topological Polar Surface Area74.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity346
Isotope Atom Count6
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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