Dimethylglyoxime

CAS 95-45-4  ·  C4H8N2O2  ·  MW 116.12 g/mol

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3D model Dimethylglyoxime, CAS 95-45-4, molecular formula C4H8N2O2, molar mass 116.12 g/mol
About Dimethylglyoxime

Dimethylglyoxime is a chemical compound registered under number CAS 95-45-4, with the molecular formula C4H8N2O2, and a molar mass of 116.12 g/mol.

The molecule contains 16 atoms connected by 15 chemical bonds. The full systematic IUPAC name of this compound is N-(3-hydroxyiminobutan-2-ylidene)hydroxylamine. 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 = 0.1 (positive value, a lipophilic compound), polar surface area PSA = 65.2 Ų, 2 donors and 4 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 formulaC4H8N2O2
Masa molowa116.12 g/mol
IUPACN-(3-hydroxyiminobutan-2-ylidene)hydroxylamine
SMILESCC(=NO)C(=NO)C
InChIKeyJGUQDUKBUKFFRO-UHFFFAOYSA-N
logP (XLogP3)0.1
PSA65.2 Ų
HBD / HBA2 / 4
PubChem CIDCID 135459645 ↗
GHS safety

Signal word: Danger

GHS02
GHS02
GHS06
GHS06

H228 — Substancja stała łatwopalna

H301 — Działa toksycznie po połknięciu

Scientific literature

Related literature

4 articles · 1 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (4 articles)

2021: 1 articles20212022: 2 articles20222024: 1 articles2024

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

Synonyms
Dimethylglyoxime · 95-45-4 · Diacetyldioxime · 2,3-Butanedione, dioxime · NSC-9 · RefChem:571275 · DTXCID601478640 · 202-420-1 · 2971MFT1KY · Biacetyl dioxime · Chugaev's reagent · Butanedione dioxime · 2,3-Diisonitrosobutane · 2,3-Butanedione dioxime · MFCD00002117
Data sources
Related molecules
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📜 License & provenanceMolGod_License_1
Model
Dimethylglyoxime · 95-45-4
License
CC BY 4.0 International (source rights undetermined — not yet granted)
Attribution
MolGod Scientific
License & provenance record
Dimethylglyoxime (CAS 95-45-4) →
MolGod molecule record
Dimethylglyoxime →
Source data
PubChem CID 135459645 ↗
SHA-256 (STL)
dc37e85cd2ccdfa821a07e187063fccb50583c904e1b02659498c6b03d6a1165
Wikimedia Commons
not published yet
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