Phenol-d6

Base Information

Chemical Name:Phenol-d6
CAS No.:13127-88-3
Molecular Formula:C6D6 O
Molecular Weight:100.065
Hs Code.:28459000
European Community (EC) Number:236-063-8
DSSTox Substance ID:DTXSID80893477
Nikkaji Number:J317.823D
Wikidata:Q72481665
Mol file:13127-88-3.mol

Synonyms:Phenol-d6;13127-88-3;Phenol D6;1,2,3,4,5-pentadeuterio-6-deuteriooxybenzene;(2H6)Phenol;Phenol-d6-;EINECS 236-063-8;perdeuterio phenol;Phenol #;C6D6O;Phenol-d6, 99 atom % D;SCHEMBL14004356;C6-D6-O;DTXSID80893477;MFCD00002144;CS-T-60356;Phenol D6 1000 microg/mL in Methanol;Phenol D6 100 microg/mL in Acetonitrile;D99540

Suppliers and Price of Phenol-d6

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

Sigma-Aldrich
Phenol-2,3,4,5,6-d5 98 atom % D
5 g
$ 480.00

Sigma-Aldrich
Phenol-d6 99 atom % D
5g
$ 272.00

Sigma-Aldrich
Phenol-2,3,4,5,6-d5 98 atom % D
1 g
$ 148.00

Sigma-Aldrich
Phenol-d6 99 atom % D
1g
$ 120.00

Medical Isotopes, Inc.
Phenol-d6
1 g
$ 490.00

Chemenu
Phenol-D6 98%
10g
$ 540.00

Apolloscientific
Phenol-D6>98Atom%D >98Atom%D
1g
$ 66.00

American Custom Chemicals Corporation
PHENOL-D6 98.00%
1G
$ 747.29

Total 39 raw suppliers

Chemical Property of Phenol-d6

Chemical Property:

Appearance/Colour:solid
Vapor Pressure:0.36 mm Hg ( 20 °C)
Melting Point:40-42 °C(lit.)
Boiling Point:182 °C(lit.)
Flash Point:72.5°C
PSA：20.23000
Density:1.071g/cm³
LogP:1.39220
Storage Temp.:2-8°C
Solubility.:84g/l
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:100.079525286
Heavy Atom Count:7
Complexity:46.1

Purity/Quality:

99%, ^*data from raw suppliers

Phenol-2,3,4,5,6-d5 98 atom % D ^*data from reagent suppliers

Safty Information:

Pictogram(s): T,C,Xn
Hazard Codes:T,C,Xn
Statements: 23/24/25-34-48/20/21/22-68-40
Safety Statements: 24/25-26-28-36/37/39-45-36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Chemical Classes:Other Classes -> Phenols
Canonical SMILES:C1=CC=C(C=C1)O
Isomeric SMILES:[2H]C1=C(C(=C(C(=C1[2H])[2H])O[2H])[2H])[2H]
Uses Phenol is purified here for molecular genetics applications. It is naturally found in tea leaves and plants, and has uses in the synthesis of antioxidant compounds due to the antioxidant activity caus ed by the phenol moiety. This structure also allows it to be used for syntheses of anti-bacterial & anti-carcinogenic compounds. This is the labelled analog.

Technology Process of Phenol-d6

There total 7 articles about Phenol-d6 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: 68.0%

: 108-95-2,27073-41-2
phenol

: 13127-88-3,80441-87-8
phenol-d6

Guidance literature:: platinum(IV) oxide; In water-d2; at 250 ℃; for 12h; under 30002.4 Torr;
DOI:10.3987/COM-05-S(T)36

Reference yield:

: 1076-43-3
benzene-d6

: 23951-01-1
<2-D>-phenol

: 4165-62-2
phenol-d5

: 13127-88-3,80441-87-8
phenol-d6

: 64045-83-6
2,3,4,5-tetradeuterio-phenol

: 143134-41-2
C₆H₂⁽²⁾H₄O

: 108-95-2,27073-41-2
phenol

Guidance literature:: With triplet atomic oxygen O(³P); at 20.9 ℃; Mechanism; Product distribution; Rate constant; other temperatures, also in mixtures with benzene (molar ratios C₆H₆:C₆D₆, 0:1, 1:1 and 9:1);

Reference yield:

: 1076-43-3
benzene-d6

: 13127-88-3,80441-87-8
phenol-d6

Guidance literature:: With tetradeuterioacetic acid; carbon monoxide; oxygen; palladium diacetate; 1,10-Phenanthroline; at 180 ℃; under 22800 Torr;
DOI:10.1246/bcsj.63.438