Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C7H5NS2.C2H7NO |
| Molecular Weight | 228.334 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NCCO.S=C1NC2=C(S1)C=CC=C2
InChI
InChIKey=BGZRCNAAUWQNRX-UHFFFAOYSA-N
InChI=1S/C7H5NS2.C2H7NO/c9-7-8-5-3-1-2-4-6(5)10-7;3-1-2-4/h1-4H,(H,8,9);4H,1-3H2
| Molecular Formula | C7H5NS2 |
| Molecular Weight | 167.251 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C2H7NO |
| Molecular Weight | 61.0831 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
DescriptionSources: https://dailymed.nlm.nih.gov/dailymed/drugInfo.cfm?setid=6bead357-f409-47aa-8cdd-d8676b7a5960https://www.cdc.gov/niosh/docs/2014-142/pdfs/2014-142.pdf | https://hazmap.nlm.nih.gov/category-details?table=copytblagents&id=7051 | http://www.emeraldmaterials.com/cms/polyadd/fis_ftp.downloadMSDS?p_filename=NAMBT_GOOD-RITE_%20SODIUM%20MBT%20Corrosion%20Inhibitor_GHS%20Internatl_English_POLADD.pdfCurator's Comment: description was created based on several sources, including
https://www.ncbi.nlm.nih.gov/pubmed/19158128
https://www.ncbi.nlm.nih.gov/pubmed/12732904
Sources: https://dailymed.nlm.nih.gov/dailymed/drugInfo.cfm?setid=6bead357-f409-47aa-8cdd-d8676b7a5960https://www.cdc.gov/niosh/docs/2014-142/pdfs/2014-142.pdf | https://hazmap.nlm.nih.gov/category-details?table=copytblagents&id=7051 | http://www.emeraldmaterials.com/cms/polyadd/fis_ftp.downloadMSDS?p_filename=NAMBT_GOOD-RITE_%20SODIUM%20MBT%20Corrosion%20Inhibitor_GHS%20Internatl_English_POLADD.pdf
Curator's Comment: description was created based on several sources, including
https://www.ncbi.nlm.nih.gov/pubmed/19158128
https://www.ncbi.nlm.nih.gov/pubmed/12732904
Sodium 2-Mercaptobenzothiazole (sodium MBT) is utilized as a
corrosion inhibitor and fungicide. By analogy to MBT, sodium MBT
is identified as a skin sensitizer. Sodium 2-Mercaptobenzothiazole is also used to make rubber accelerators, as a preservative for latex paint and wood, a metal chelator, and a thermal stabilizer (methyl methacrylate copolymers, acrylonitrile polymers, polyester fibers, anion exchange resins, polyoxyphenylene, and silicon fluids), also used in electroplating (silver, nickel, and cobalt), to separate sulfide ore from copper ore, for dyeing textiles, in transmission fluids, and to prevent discoloration of freeze dried bananas; uses of 50% aqueous solution include as a corrosion inhibitor for nonferrous metals in antifreeze and coolants and in paper mill systems; used as a biocide in metalworking fluids and paper manufacturing.
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: P14650 Gene ID: NA Gene Symbol: Tpo Target Organism: Rattus norvegicus (Rat) |
|||
Target ID: CHEMBL3102 |
Conditions
| Condition | Modality | Targets | Highest Phase | Product |
|---|---|---|---|---|
| Palliative | Unknown Approved UseUnknown |
|||
| Palliative | Unknown Approved UseUnknown |
PubMed
| Title | Date | PubMed |
|---|---|---|
| Appraisal of the sensitising potential of orally and dermally administered mercaptobenzothiazole by a biphasic protocol of the local lymph node assay. | 2009-10 |
|
| Rhenium(I) tricarbonyl complexes with poly(azolyl)borates generated in situ from an organometallic precursor containing the B-H...Re coordination motif. | 2009-05-04 |
|
| A polynuclear d10-d10 metal complex with unusual near-infrared luminescence and high thermal stability. | 2009-04-06 |
|
| Expression of surface markers on the human monocytic leukaemia cell line, THP-1, as indicators for the sensitizing potential of chemicals. | 2009-04 |
|
| Cancer risks in chemical production workers exposed to 2-mercaptobenzothiazole. | 2009-04 |
|
| Synthesis, characterization, and biological studies of organotin(IV) derivatives with o- or p-hydroxybenzoic acids. | 2009 |
|
| Predicting the binding capability of benzothiazoline-2-thione and its derivatives with gold: a DFT and FT-Raman combined studies. | 2008-12-15 |
|
| Profiling and imaging of lipids on brain and liver tissue by matrix-assisted laser desorption/ ionization mass spectrometry using 2-mercaptobenzothiazole as a matrix. | 2008-12-01 |
|
| The effective and specific isolation of antibodies from human serum by using thiophilic paramagnetic polymer beads. | 2008-12-01 |
|
| Structural motifs of diiodine complexes with amides and thioamides. | 2008-10-14 |
|
| Mercaptobenzothiazole and mercapto mix. | 2008-10-11 |
|
| Reactivity of in vitro activated human T lymphocytes to p-phenylenediamine and related substances. | 2008-10 |
|
| Bladder cancer risks in workers manufacturing chemicals for the rubber industry. | 2008-10 |
|
| Re-creation of historical chrysotile-containing joint compounds. | 2008-09 |
|
| Positive patch-test reactions to mixed dialkyl thioureas: cross-sectional data from the North American Contact Dermatitis Group, 1994 to 2004. | 2008-08-05 |
|
| North American Contact Dermatitis Group patch-test results, 2003-2004 study period. | 2008-07-17 |
|
| The oxidative degradation of 2-mercaptobenzothiazole at the interface of beta-MnO2 and water. | 2008-06-15 |
|
| Photodegradation of 2-mercaptobenzothiazole in the gamma-Fe(2)O(3)/oxalate suspension under UVA light irradiation. | 2008-05-01 |
|
| [Occupational contact dermatitis in metal workers and gender effect]. | 2008-04-16 |
|
| Evaluation of a carbon paste electrode modified with organofunctionalised SBA-15 nanostructured silica in the simultaneous determination of divalent lead, copper and mercury ions. | 2008-03-15 |
|
| Simultaneous square wave voltammetric determination of 2-mercaptobenzothiazole and 2-mercaptobenzoxazole by partial least squares method in water samples. | 2008-03-01 |
|
| A collaborative epidemiological investigation into the criminal fake artesunate trade in South East Asia. | 2008-02 |
|
| Biological studies of new organotin(IV) complexes of thioamide ligands. | 2008-02 |
|
| A combined patch-clamp and electrorotation study of the voltage- and frequency-dependent membrane capacitance caused by structurally dissimilar lipophilic anions. | 2008-01 |
|
| Mercaptobenzothiazole allergenicity-role of the thiol group. | 2008 |
|
| Crystal structure and antitumor activity of the novel zwitterionic complex of tri-n-butyltin(IV) with 2-thiobarbituric acid. | 2008 |
|
| Comparison of the adsorption orientation for 2-mercaptobenzothiazole and 2-mercaptobenzoxazole by SERS spectroscopy. | 2007-12-31 |
|
| Epidemio-allergological study in 155 cases of footwear dermatitis. | 2007-10-09 |
|
| Patch testing experience with 1000 patients. | 2007-10-09 |
|
| Cross-reactions between xanthates and rubber additives. | 2007-09 |
|
| Chemical changes in rubber allergens during vulcanization. | 2007-09 |
|
| Oxidation of 2-mercaptobenzothiazole in latex gloves and its possible haptenation pathway. | 2007-08 |
|
| 20 Years of standard patch testing in an eczema population with focus on patients with multiple contact allergies. | 2007-08 |
|
| Contact dermatitis to a rubber allergen with both dithiocarbamate and benzothiazole structure. | 2007-05 |
|
| Acetylcholinesterase-polyaniline biosensor investigation of organophosphate pesticides in selected organic solvents. | 2007-04-25 |
|
| Zebrafish as a new model for phenotype-based screening of melanogenic regulatory compounds. | 2007-04 |
|
| Synthesis, structural characterization, and biological studies of six- and five-coordinate organotin(IV) complexes with the thioamides 2-mercaptobenzothiazole, 5-chloro-2-mercaptobenzothiazole, and 2-mercaptobenzoxazole. | 2007-02-19 |
|
| Matrix-assisted laser desorption/ionization-mass spectrometry of hydrophobic proteins in mixtures using formic acid, perfluorooctanoic acid, and sorbitol. | 2007-02-01 |
|
| The nature of the chemical bond in linear three-body systems: from i3- to mixed chalcogen/halogen and trichalcogen moieties. | 2007 |
|
| Fmoc-2-mercaptobenzothiazole, for the introduction of the Fmoc moiety free of side-reactions. | 2007 |
|
| Condom leukoderma. | 2006-12-21 |
|
| Very small and soft scorpionates: water stable technetium tricarbonyl complexes combining a bis-agostic (k(3)-H, H, S) binding motif with pendant and integrated bioactive molecules. | 2006-11-15 |
|
| Respective contributions of polar vs enthalpy effects in the addition/fragmentation of mercaptobenzoxazole-derived thiyl radicals and analogues to double bonds. | 2006-10-19 |
|
| Application of 2-mercaptobenzothiazole self-assembled monolayer on polycrystalline gold electrode as a nanosensor for determination of Ag(I). | 2006-05-15 |
|
| Pressure-tuning Raman spectra of diiodine thioamide compounds: models for antithyroid drug activity. | 2006 |
|
| Interaction of thioamides, selenoamides, and amides with diiodine. | 2006 |
|
| Reactions Between Chalcogen Donors and Dihalogens/Interalogens: Typology of Products and Their Characterization by FT-Raman Spectroscopy. | 2006 |
|
| Electroreduction of the antifouling agent TCMTB and its electroanalytical determination in tannery wastewaters. | 2005-10-15 |
|
| Evaluation of a carbon paste electrode modified with organofunctionalized amorphous silica in the cadmium determination in a differential pulse anodic stripping voltammetric procedure. | 2003-04-10 |
|
| Indirect extraction-spectrophotometric determination of 2-(thiocyanomethylthiol)benzothiazole in chrome tanning liquors after its breakdown to 2-mercaptobenzothiazole. | 2002-03-04 |
Patents
Sample Use Guides
only for animals: Apply generously to affected areas once or twice daily. Rub into skin with fingertips.
Route of Administration:
Topical
In Vitro Use Guide
Sources: https://www.ncbi.nlm.nih.gov/pubmed/23178179
2-Mercaptobenzothiazole (MBT), a high production volume chemical, was tested and shown to inhibit thyroid peroxidase (TPO) enzyme activity in vitro, a key enzyme necessary for the synthesis of thyroid hormone.
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 21:45:17 GMT 2025
by
admin
on
Mon Mar 31 21:45:17 GMT 2025
|
| Record UNII |
B9KE7SN83F
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Preferred Name | English | ||
|
Common Name | English | ||
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English | ||
|
Common Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
|
EPA PESTICIDE CODE |
51706
Created by
admin on Mon Mar 31 21:45:17 GMT 2025 , Edited by admin on Mon Mar 31 21:45:17 GMT 2025
|
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
DTXSID5058432
Created by
admin on Mon Mar 31 21:45:17 GMT 2025 , Edited by admin on Mon Mar 31 21:45:17 GMT 2025
|
PRIMARY | |||
|
227-597-2
Created by
admin on Mon Mar 31 21:45:17 GMT 2025 , Edited by admin on Mon Mar 31 21:45:17 GMT 2025
|
PRIMARY | |||
|
68089
Created by
admin on Mon Mar 31 21:45:17 GMT 2025 , Edited by admin on Mon Mar 31 21:45:17 GMT 2025
|
PRIMARY | |||
|
3037135
Created by
admin on Mon Mar 31 21:45:17 GMT 2025 , Edited by admin on Mon Mar 31 21:45:17 GMT 2025
|
PRIMARY | |||
|
5902-85-2
Created by
admin on Mon Mar 31 21:45:17 GMT 2025 , Edited by admin on Mon Mar 31 21:45:17 GMT 2025
|
PRIMARY | |||
|
B9KE7SN83F
Created by
admin on Mon Mar 31 21:45:17 GMT 2025 , Edited by admin on Mon Mar 31 21:45:17 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
PARENT -> SALT/SOLVATE |
|