1H-Benzotriazole

CAS 95-14-7  ·  C6H5N3  ·  MW 119.12 g/mol

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3D model 1H-Benzotriazole, CAS 95-14-7, molecular formula C6H5N3, molar mass 119.12 g/mol
About 1H-Benzotriazole

1H-Benzotriazole is a chemical compound registered under number CAS 95-14-7, with the molecular formula C6H5N3, and a molar mass of 119.12 g/mol.

The molecule contains 14 atoms connected by 15 chemical bonds. The full systematic IUPAC name of this compound is 2H-benzotriazole. 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 = 1 (positive value, a lipophilic compound), polar surface area PSA = 41.6 Ų, 1 donors and 2 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 widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC6H5N3
Masa molowa119.12 g/mol
IUPAC2H-benzotriazole
SMILESC1=CC2=NNN=C2C=C1
InChIKeyQRUDEWIWKLJBPS-UHFFFAOYSA-N
logP (XLogP3)1
PSA41.6 Ų
HBD / HBA1 / 2
PubChem CIDCID 7220 ↗
GHS safety

Signal word: Warning

GHS09
GHS09

H411 — Działa toksycznie na organizmy wodne, powodując długotrwałe skutki

Scientific literature

Related literature

20 articles · 8 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (20 articles)

1982: 1 articles19821996: 1 articles1999: 1 articles2001: 1 articles2002: 1 articles2007: 1 articles2008: 4 articles20082010: 2 articles2011: 3 articles2012: 1 articles2016: 2 articles2019: 1 articles2020: 1 articles2020

Bar height = number of articles per year. Hover dla szczegółów.

Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
1H-Benzotriazole · Benzotriazole · 95-14-7 · 1,2,3-BENZOTRIAZOLE · Azimidobenzene · 1H-1,2,3-Benzotriazole · Benzisotriazole · Aziminobenzene · Benztriazole · Benzene azimide · 2,3-Diazaindole · 1,2-Aminoazophenylene · 1,2,3-1h-benzotriazole · 1,2,3-Triazaindene · Cobratec 99
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
1H-Benzotriazole — CAS 95-14-7

License: CC BY-SA 4.0 (source rights NIEUSTALONE — not yet granted for this model)

MolGod License & Provenance Record:
1H-Benzotriazole (CAS 95-14-7) — License & Provenance

Source:
1H-Benzotriazole (CAS 95-14-7) — MolGod molecule record

Source data: PubChem CID 7220

STL: Download 3D model (289 KB)

SHA-256: 326523aed4ce6ab02d81bafbf99f18012bc3f77130454c969dc58847b3171879

Wikimedia Commons: not published yet

Source data: PubChem CID 7220

This licence applies to the MolGod-created STL mesh, not automatically to third-party source material.