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

Base Information

Chemical Name:Benzophenone-2,3,4,5,6-d5
CAS No.:2694-78-2
Molecular Formula:C6D5COC6H5
Molecular Weight:187.182
Hs Code.:
European Community (EC) Number:688-585-4
DSSTox Substance ID:DTXSID80480588
Nikkaji Number:J540.219K
Wikidata:Q82315478
Mol file:2694-78-2.mol

Synonyms:Benzophenone-2,3,4,5,6-d5;2694-78-2;benzophenone-d5;(2,3,4,5,6-pentadeuteriophenyl)-phenylmethanone;perdeutero-benzophenone;SCHEMBL1331878;DTXSID80480588;HY-Y0546S1;AKOS015889527;CS-0432591;phenyl[(2,3,4,5,6-?H?)phenyl]methanone;Benzophenone-2,3,4,5,6-d5, 98 atom % D;D99168;J-016630;(2, 3, 4, 5, 6-pentadeuteriophenyl)-phenylmethanone

Suppliers and Price of Benzophenone-2,3,4,5,6-d5

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Benzophenone-2,3,4,5,6-d5
10mg
$ 45.00

Medical Isotopes, Inc.
Benzophenone-2,3,4,5,6-d5
1 g
$ 775.00

American Custom Chemicals Corporation
BENZOPHENONE-2,3,4,5,6-D5 95.00%
1G
$ 794.36

Total 9 raw suppliers

Chemical Property of Benzophenone-2,3,4,5,6-d5

Chemical Property:

Vapor Pressure:0.000823mmHg at 25°C
Melting Point:47-51oC(lit.)
Boiling Point:305oC(lit.)
Flash Point:123.7oC
PSA：17.07000
Density:1.117g/cm3
LogP:2.91760
Storage Temp.:Room Temperature
Solubility.:Chloroform (Slightly), Methanol (Slightly)
XLogP3:3.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:187.104548668
Heavy Atom Count:14
Complexity:165

Purity/Quality:

99% ^*data from raw suppliers

Benzophenone-2,3,4,5,6-d5 ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
Isomeric SMILES:[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=O)C2=CC=CC=C2)[2H])[2H]
Uses Benzophenone-2,3,4,5,6-d5 is derived from Benzene-d6 (B185282), which is an isotope labelled benzene, an organic compound that is a natural constituent of crude oil and one of the most basic petrochemicals.

Technology Process of Benzophenone-2,3,4,5,6-d5

There total 11 articles about Benzophenone-2,3,4,5,6-d5 which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 94.0%

: 95450-78-5,99398-35-3
pentadeuterophenyl-phenyl-methanol

: 2694-78-2
2,3,4,5,6-Pentadeuteriobenzophenon

Guidance literature:: With pyridinium chlorochromate; In dichloromethane; at 20 ℃;
DOI:10.1002/anie.201207479

Reference yield: 89.0%

: 1076-43-3
benzene-d6

: 98-88-4
benzoyl chloride

: 2694-78-2
2,3,4,5,6-Pentadeuteriobenzophenon

Guidance literature:: benzene-d6; With aluminum (III) chloride; at 0 ℃; for 0.5h; Inert atmosphere;

benzoyl chloride; at 0 - 20 ℃;
DOI:10.1002/jlcr.1877