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Benzophenone-2,3,4,5,6-d5

CAT: 1459-CS-C-00216Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-C-00216Size:1 Each
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Description
Benzophenone-2,3,4,5,6-d5 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Benzophenone. The product is supplied by Clearsynth under CAT No. CS-C-00216. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Benzophenone-2,3,4,5,6-D5 is an organic compound that is a natural constituent of crude oil and one of the most basic petrochemicals.
CAS Number
2694-78-2
Synonyms
Benzophenone-2,3,4,5,6-d5
Molecular Formula
C 13 H 5 D 5 O
Molecular Weight
187.25
Additionnal Information
Benzophenone-2,3,4,5,6-d5 is supplied with detailed characterization data compliant with regulatory guideline. Benzophenone-2,3,4,5,6-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 Benzophenone.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Benzophenone-2,3,4,5,6-D5 is an organic compound that is a natural constituent of crude oil and one of the most basic petrochemicals.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

Benzophenone-2,3,4,5,6-d5
CAS Number2694-78-2
PubChem CID12210018
IUPAC Name(2,3,4,5,6-pentadeuteriophenyl)-phenylmethanone
Molecular FormulaC13H10O
Molecular Weight187.25
XLogP3.4
Topological Polar Surface Area17.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count14
Formal Charge0
Complexity165
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=O)C2=CC=CC=C2)[2H])[2H]
InChI
InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H/i1D,3D,4D,7D,8D
InChIKey
RWCCWEUUXYIKHB-DYVTXVBDSA-N
Chemical Structure
2D Structure
2D structure of Benzophenone-2,3,4,5,6-d5
CAS: 2694-78-2
CID: 12210018
Formula: C13H10O
MW: 187.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight187.25
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass187.104548668
Monoisotopic Mass187.104548668
Topological Polar Surface Area17.1 Ų
Heavy Atom Count14
Formal Charge0
Complexity165
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