BENZENE (1,3,5-D3)

Base Information

• Chemical Name: BENZENE (1,3,5-D3)
• CAS No.: 1684-47-5
• Molecular Formula: C6H3D3
• Molecular Weight: 81.0898
• Mol file: 1684-47-5.mol

Synonyms:1,3,5-Trideuterobenzene;1,3,5-Trideuteriobenzene;

Chemical Property of BENZENE (1,3,5-D3)

Chemical Property:

• Vapor Pressure: 101mmHg at 25°C
• Melting Point: 5.5 °C(lit.)
• Refractive Index: n20/D 1.499(lit.)
• Boiling Point: 78.8 °C at 760 mmHg
• Flash Point: 12 °F
• PSA: 0.00000
• Density: 0.907 g/cm³
• LogP: 1.68660

Purity/Quality:

99% ^*data from raw suppliers

Benzene-d3 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F, T
• Hazard Codes: F,T
• Statements: 45-46-11-36/38-48/23/24/25-65
• Safety Statements: 53-45

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of BENZENE (1,3,5-D3)

There total 6 articles about BENZENE (1,3,5-D3) 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:

benzene-1,3,5-tricarboxylic acid (554-95-0) → 1,3,5-trideuteriobenzene (1684-47-5)

Guidance literature:

With Ca(OD)2;

DOI:10.1038/137070a0

Reference yield:

(C5(CH3)5)Rh(P(CH3)3)(C6H3(CH3)2)(2)H + benzene-d6 (1076-43-3) → (η5-C5Me5)Rh{PMe3}{C6(2)H5}(2)H + 1,3,5-trideuteriobenzene (1684-47-5)

Guidance literature:

In benzene-d6; heating (C5Me5)Rh(PMe3)(3,5-C6H3Me2)D in C6D6 at 51.2°C; Kinetics;

DOI:10.1021/ja00276a019

Reference yield:

aniline hydrochloride (142-04-1,36663-09-9) → 1,3,5-trideuteriobenzene (1684-47-5)

Guidance literature:

With water-d2; at 100 ℃; anschliessende Diazotierung und Behandlung der Diazoniumsalz-Loesung mit wss.-alkal. Natriumstannit-Loesung;

DOI:10.1039/jr9460000239

upstream raw materials:

benzene-1,3,5-tricarboxylic acid

aniline hydrochloride

benzene-d6

Downstream raw materials:

1,3,5-trideutero-2-fluorobenzene

C₂₁H₂₃⁽²⁾H₂NO

C₂₁H₂₂⁽²⁾H₃NO

Refernces

• 1、 Jones, William D.,Feher, Frank J.. "Isotope Effects in Arene C-H Bond Activation by ". . p. 4814 - 4819. Retrieved 2007/10/02.