Zinc mercaptobenzothiazole

CAS 155-04-4  ·  C₁₄H₈N₂S₄Zn  ·  MW 397.9 g/mol

Full record: Zinc mercaptobenzothiazole — Safety Data Sheet →

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3D model Zinc mercaptobenzothiazole, CAS 155-04-4, molecular formula C₁₄H₈N₂S₄Zn, molar mass 397.9 g/mol
About Zinc mercaptobenzothiazole

Zinc mercaptobenzothiazole is a chemical compound registered under number CAS 155-04-4, with the molecular formula C₁₄H₈N₂S₄Zn, and a molar mass of 397.9 g/mol.

The molecule contains 29 atoms connected by 30 chemical bonds. The full systematic IUPAC name of this compound is zinc bis(1,3-benzothiazole-2-thiolate). The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, polar surface area PSA = 84.3 Ų, 0 donors and 6 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Physicochemical properties
Molecular formulaC₁₄H₈N₂S₄Zn
Molar mass397.9 g/mol
IUPACzinc bis(1,3-benzothiazole-2-thiolate)
SMILESC1=CC=C2C(=C1)N=C(S2)[S-].C1=CC=C2C(=C1)N=C(S2)[S-].[Zn+2]
InChIKeyPGNWIWKMXVDXHP-UHFFFAOYSA-L
logP (XLogP3)—
PSA84.3 Ų
HBD / HBA0 / 6
PubChem CIDCID 9071 ↗
GHS safety

Signal word: Danger

GHS07
GHS07
GHS08
GHS08
GHS09
GHS09

H317 — May cause an allergic skin reaction

H350 — May cause cancer

H400 — Very toxic to aquatic life

H410 — Very toxic to aquatic life with long lasting effects

Scientific literature

Related literature

3 articles · 2 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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📈 Publication timeline (number of articles: 3)

1993: number of articles 119932023: number of articles 120232024: number of articles 12024

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Data from PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary generated by Semantic Scholar TLDR. Articles marked with require paid access.

Data sources
📜 License & provenanceMolGod_License_1
Model
Zinc mercaptobenzothiazole · 155-04-4
InChIKey
PGNWIWKMXVDXHP-UHFFFAOYSA-L
License & provenance record
Zinc mercaptobenzothiazole (CAS 155-04-4) →
MolGod molecule record
Zinc mercaptobenzothiazole →
Source data
PubChem CID 9071 ↗
Model information
not published yet

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