5,6-Dichloro-1H-benzimidazole-2-thiol

CAS 19462-98-7  ·  C7H4Cl2N2S  ·  MW 219.09 g/mol

Full record: 5,6-Dichloro-1H-benzimidazole-2-thiol — Safety Data Sheet →

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3D model 5,6-Dichloro-1H-benzimidazole-2-thiol, CAS 19462-98-7, molecular formula C7H4Cl2N2S, molar mass 219.09 g/mol

Model views

  • 5,6-Dichloro-1H-benzimidazole-2-thiol (CAS 19462-98-7) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • 5,6-Dichloro-1H-benzimidazole-2-thiol (CAS 19462-98-7) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • 5,6-Dichloro-1H-benzimidazole-2-thiol (CAS 19462-98-7) – 2D structure, MolGod Viewer
    2D structure

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About 5,6-Dichloro-1H-benzimidazole-2-thiol

5,6-Dichloro-1H-benzimidazole-2-thiol is a chemical compound registered under number CAS 19462-98-7, with the molecular formula C7H4Cl2N2S, and a molar mass of 219.09 g/mol.

The molecule contains 16 atoms connected by 17 chemical bonds. The full systematic IUPAC name of this compound is 5,6-dichloro-1,3-dihydrobenzimidazole-2-thione. 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, the partition coefficient logP = 2.4 (positive value, a lipophilic compound), polar surface area PSA = 56.2 Ų, 2 donors and 1 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 formulaC7H4Cl2N2S
Molar mass219.09 g/mol
IUPAC5,6-dichloro-1,3-dihydrobenzimidazole-2-thione
SMILESC1=C2C(=CC(=C1Cl)Cl)NC(=S)N2
InChIKeyAFDOMGKBKBKUHB-UHFFFAOYSA-N
logP (XLogP3)2.4
PSA56.2 Ų
HBD / HBA2 / 1
PubChem CIDCID 2774259 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H315 — Causes skin irritation

H319 — Causes serious eye irritation

H335 — May cause respiratory irritation

Scientific literature

Brak articles naukowych dla CAS 19462-98-7 w PubMed / OpenAlex / Semantic Scholar.

Synonyms
5,6-Dichloro-1H-benzimidazole-2-thiol · RefChem:527985 · 640-442-7 · 19462-98-7 · 5,6-dichloro-1H-benzo[d]imidazole-2-thiol · 5,6-dichlorobenzimidazole-2-thiol · 5,6-dichloro-1,3-dihydrobenzimidazole-2-thione · 5,7diCl2SH-BzInd · 2-Mercapto-5,6-dichlorobenzimidazole · 5,6-DICHLORO-2-MERCAPTOBENZIMIDAZOLE · MFCD00052398 · NSC140854 · AP6JYC35KQ · 2H-Benzimidazole-2-thione, 5,6-dichloro-1,3-dihydro- · 5,6-Dichloro-1,3-dihydro-2H-benzo[d]imidazole-2-thione
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
5,6-Dichloro-1H-benzimidazole-2-thiol · 19462-98-7
InChIKey
AFDOMGKBKBKUHB-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — 5,6-Dichloro-1H-benzimidazole-2-thiol (CAS 19462-98-7)
License & provenance record
5,6-Dichloro-1H-benzimidazole-2-thiol (CAS 19462-98-7) →
MolGod molecule record
5,6-Dichloro-1H-benzimidazole-2-thiol →
Source data
PubChem CID 2774259 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
5014973e49c4c503eace0c34e8c80655ac5cb7bfe1ead2f33f3068a4bc90f86f
MD5 (STL)
e18ff5e37e78d401090eee03a95b8616
MolGod Identification Number
MG_379-505-988-40
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
not published yet
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