ZINC DIBUTYLDITHIOCARBAMATE

US Approved Allergenic Extract (1994)

Details

Stereochemistry	ACHIRAL
Molecular Formula	2C9H18NS2.Zn
Molecular Weight	474.161
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ZINC DIBUTYLDITHIOCARBAMATE

Structure Search

SMILES

[Zn++].CCCCN(CCCC)C([S-])=S.CCCCN(CCCC)C([S-])=S

InChI

InChIKey=BOXSVZNGTQTENJ-UHFFFAOYSA-L

InChI=1S/2C9H19NS2.Zn/c2*1-3-5-7-10(9(11)12)8-6-4-2;/h2*3-8H2,1-2H3,(H,11,12);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula	Zn
Molecular Weight	65.409
Charge	2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C9H19NS2
Molecular Weight	205.384
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/6202764
Curator's Comment: description was created based on several sources, including https://www.ncbi.nlm.nih.gov/pubmed/689578 | https://www.ncbi.nlm.nih.gov/pubmed/16088893

Zinc dibutyldithiocarbamate (Zn DBDTC) is a vulcanization accelerator for natural rubber and latex and a stabilizer for rubber-based adhesive systems, isobutylene-isoprene copolymers and polypropylene. It is used in a number of rubber and rubber-based materials for food packaging and food handling, e.g. conveyor belts. Zinc dibutyldithiocarbamate (Zn DBDTC) is contact allergens that cross-react in some individuals. Zinc dibutyldithiocarbamate, like many low-molecular-weight contact allergens, can only trigger an immune response when bound to a protein in the form of an immunogenic protein–hapten complex. Haptenation of epidermally relevant skin proteins by Zinc dibutyldithiocarbamate has not been reported despite the numerous studies on the disposition and systemic toxicity of Zinc dibutyldithiocarbamate. The chelating properties of the dithiocarbamate ligand have been proposed to be responsible for the modification of some metalloproteins and metalloenzymes

Originator

Approval Year

Conditions

Condition	Modality	Targets	Highest Phase	Product
Unknown 2578

PubMed

Title	Date	PubMed
Extraction of haptens from solid products and their delivery to the skin, exemplified by dithiocarbamates from rubber gloves.	2005 Jul	15982227
In vitro induction of polyploidy and chromatid exchanges by culture medium extracts of natural rubbers compounded with 2-mercaptobenzothiazole as a positive control candidate for genotoxicity tests.	2005 Nov 1	16088893

Patents

Sample Use Guides

In Vivo Use Guide

Groups of 15 male and 15 female rats were given diets contain!ng 0 (control), 100, 500 or 2500 ppm ZnDBDTC for 17wk.

Route of Administration: Oral

In Vitro Use Guide

Model materials of three rubber sheets (Sample C contained ZDBC; thickness, 1 mm) were prepared. Materials were cut into approximately 2 x 15 mm pieces. The pieces (1 g) were put into a centrifuge tube, and 10 mL MEM supplemented with 5% FCS, nonessential amino acids, and 1 mM sodium pyruvate (5% FCS-GMNP) was added. After incubation at 37°C in a humidified atmosphere for 24 h, the extract, designated 100%, was decanted and serially diluted with 5% FCS-GMNP to give 80%, 64%, 51%, and 41% extracts.

Substance Class	Chemical Created by `admin` on `Sat Dec 16 06:16:50 GMT 2023` Edited by `admin` on `Sat Dec 16 06:16:50 GMT 2023`
Record UNII	HNM5J934VP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ZINC DIBUTYLDITHIOCARBAMATE

Official Name

English

NSC-36548

Code

English

ZINC, BIS(DIBUTYLDITHIOCARBAMATO)- [HSDB]

Common Name

English

ZINC, BIS(DIBUTYLCARBAMODITHIOATO-S,S')-

Common Name

English

ZINC DIBUTYLDITHIOCARBAMATE [INCI]

Common Name

English

ZINCDIBUTYLDITHIOCARBAMATE

Common Name

English

ZINC BIS(DIBUTYLDITHIOCARBAMATE)

Systematic Name

English

NSC-3880

Code

English

Classification Tree Code System Code

NDF-RT

N0000185508