Sodium dibenzyldithiocarbamate

Base Information

• Chemical Name: Sodium dibenzyldithiocarbamate
• CAS No.: 55310-46-8
• Molecular Formula: C15H14NNaS2
• Molecular Weight: 295.405
• Hs Code.: 2930909090
• European Community (EC) Number: 259-587-9
• DSSTox Substance ID: DTXSID8069012
• Nikkaji Number: J208.290J
• Mol file: 55310-46-8.mol

Synonyms:Sodium dibenzyldithiocarbamate;55310-46-8;sodium dibenzylcarbamodithioate;Dibenzyldithiocarbamic acid sodium salt;sodium;N,N-dibenzylcarbamodithioate;Carbamodithioic acid, bis(phenylmethyl)-, sodium salt;NSC658781;EINECS 259-587-9;dibenzylcarbamodithioic acid;SODIUM (DIBENZYLCARBAMOTHIOYL)SULFANIDE;EC 259-587-9;sodiumdibenzylcarbamodithioate;SCHEMBL700766;DTXSID8069012;MYCPTMLDBVIIES-UHFFFAOYSA-M;SODIUM DIBENZYLDITHIO CARBAMATE;AKOS016036578;CS-W012157;AS-81534;N,N-dibenzyldithiocarbamic acid sodium salt;D0156;NS00088885;D77729;Carbamodithioic acid, N,N-bis(phenylmethyl)-, sodium salt (1:1)

Chemical Property of Sodium dibenzyldithiocarbamate

Chemical Property:

• Melting Point: 235 °C (dec.)(lit.)
• Boiling Point: 408.3 °C at 760 mmHg
• Flash Point: 200.8 °C
• PSA: 35.33000
• LogP: 3.52060
• Storage Temp.: Refrigerator
• Solubility.: almost transparency in EtOH
• Water Solubility.: 178.5g/L at 25℃
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 295.04653608
• Heavy Atom Count: 19
• Complexity: 241

Purity/Quality:

98% ^*data from raw suppliers

Sodium Dibenzyldithiocarbamate Hydrate >98.0%(T) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 22
• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].[Na+]

Technology Process of Sodium dibenzyldithiocarbamate

There total 5 articles about Sodium dibenzyldithiocarbamate 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: 54.0%

carbon disulfide (75-15-0,12122-00-8) + dibenzylamine (103-49-1) → sodium dibenzyldithiocarbamate (55310-46-8)

Guidance literature:

dibenzylamine; With sodium hydroxide; In ethanol; at 0 ℃; for 0.5h;

carbon disulfide; In ethanol; for 3h;

DOI:10.1080/00958972.2021.1887482

Reference yield:

sodium O-ethyl dithiocarbonate (140-90-9) + C18H19NOS4 → bis-ethoxythiocarbonyldisulfane (502-55-6) + sodium dibenzyldithiocarbamate (55310-46-8)

Guidance literature:

With sodium nitrate; C₈MoN₈^(3-)*3Na⁽¹⁺⁾; In water; acetone; at 25 ℃; Rate constant; Equilibrium constant; μ 0.2 mol/l;

Reference yield:

bis(dibenzylthiocarbamoyl)disulfide (10591-85-2) + sodium O-ethyl dithiocarbonate (140-90-9) → sodium dibenzyldithiocarbamate (55310-46-8) + C18H19NOS4

Guidance literature:

With sodium nitrate; C₈MoN₈^(3-)*3Na⁽¹⁺⁾; In water; acetone; at 25 ℃; Rate constant; Equilibrium constant; μ 0.2 mol/l;

upstream raw materials:

bis(dibenzylthiocarbamoyl)disulfide

sodium O-ethyl dithiocarbonate

sodium N,N'-diisopropyldithiocarbamate

carbon disulfide

Downstream raw materials:

sodium O-ethyl dithiocarbonate

Ru(4,4'-(COOH)2-2,2'-bipyridine)(4-(COOH)-4'-(COO)-2,2'-bipyridine)(dibenzyldithiocarbamate)

platinum(II) dibenzyldithiocarbamate

C₂₅H₂₁NS₂Te

Refernces

• 1、 Nasir, Jamal Abdul,Ambareen, Hina,Khan, Azam,Abdullah Khan,Chen, Wei,Akhter,Zia-Ur-Rehman. "Photoreduction of 4-nitrophenol to 4-aminophenol Using CdS nanorods". . p. 7516 - 7522. Retrieved 2018.
• 2、 Ajibade, Peter A.,Sikakane, Berlinda M.,Oluwalana, Abimbola E.,Paca, Athandwe M.,Singh, Moganavelli. "Synthesis, crystal structure and in vitro anticancer studies of bis(dibenzyldithiocarbamato)Zn(II)". . p. 1244 - 1254. Retrieved 2021/02/26.
• 3、 -. "Application of dibenzyl dithiocarbamate drug for treating tri-negative breast cancer". Paragraph 0006-0007. . Retrieved 2021/09/29.