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Acetophenone-d5

CAT: 1459-CS-O-02954Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-02954Size:1 Each
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Description
Acetophenone-d5 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Acetophenone. The product is supplied by Clearsynth under CAT No. CS-O-02954. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
A Key reagents in preparation of __Deuterated Drug .Serves as a solvent or standard in NMR spectroscopy.Labeled Acetophenone, intended for use as an internal standard for the quantification of Acetophenone by GC- or LC-mass spectrometry. Uses Deuterium labelled form of acetophenone, a reagent used in the production of fragrances and resin polymers
CAS Number
28077-64-7
Synonyms
Acetophenone-d5
Molecular Formula
C 8 H 3 D 5 O
Molecular Weight
125.18
Additionnal Information
Acetophenone-d5 is supplied with detailed characterization data compliant with regulatory guideline. Acetophenone-d5 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 Acetophenone.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
A Key reagents in preparation of __Deuterated Drug .Serves as a solvent or standard in NMR spectroscopy.Labeled Acetophenone, intended for use as an internal standard for the quantification of Acetophenone by GC- or LC-mass spectrometry. Uses Deuterium labelled form of acetophenone, a reagent used in the production of fragrances and resin polymers
HSN Code
38229010
Hazard Compound
Refer MSDS for accurate information.

Chemical Information

Acetophenone-2',3',4',5',6'-d5
CAS Number28077-64-7
PubChem CID11457690
IUPAC Name1-(2,3,4,5,6-pentadeuteriophenyl)ethanone
Molecular FormulaC8H8O
Molecular Weight125.18
XLogP1.6
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity101
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=O)C)[2H])[2H]
InChI
InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3/i2D,3D,4D,5D,6D
InChIKey
KWOLFJPFCHCOCG-VIQYUKPQSA-N
Chemical Structure
2D Structure
2D structure of Acetophenone-2',3',4',5',6'-d5
CAS: 28077-64-7
CID: 11457690
Formula: C8H8O
MW: 125.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight125.18
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass125.088898604
Monoisotopic Mass125.088898604
Topological Polar Surface Area17.1 Ų
Heavy Atom Count9
Formal Charge0
Complexity101
Isotope Atom Count5
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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Alternative Products

CatalogName
DBA07764-01Acetophenone-d5
HY-Y0989S-01Acetophenone- (phenyl-d5)
sc-257060Acetophenone-2',3',4',5',6'-d5
MBS5758342Acetophenone

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