N-Acetyl-L-Cysteine

CAS 616-91-1  ·  C5H9NO3S  ·  MW 163.20 g/mol

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3D model N-Acetyl-L-Cysteine, CAS 616-91-1, molecular formula C5H9NO3S, molar mass 163.20 g/mol
About N-Acetyl-L-Cysteine

N-Acetyl-L-Cysteine is a chemical compound registered under number CAS 616-91-1, with the molecular formula C5H9NO3S, and a molar mass of 163.20 g/mol.

The molecule contains 19 atoms connected by 18 chemical bonds. The full systematic IUPAC name of this compound is (2R)-2-acetamido-3-sulfanylpropanoic acid. 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 = 0.4 (positive value, a lipophilic compound), polar surface area PSA = 67.4 Ų, 3 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 formulaC5H9NO3S
Masa molowa163.20 g/mol
IUPAC(2R)-2-acetamido-3-sulfanylpropanoic acid
SMILESCC(=O)N[C@@H](CS)C(=O)O
InChIKeyPWKSKIMOESPYIA-BYPYZUCNSA-N
logP (XLogP3)0.4
PSA67.4 Ų
HBD / HBA3 / 4
PubChem CIDCID 12035 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H319 — Działa drażniąco na oczy

Scientific literature

Related literature

10 articles · 9 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (10 articles)

2024: 3 articles20242025: 6 articles20252026: 1 articles2026

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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
N-Acetyl-L-cysteine · acetylcysteine · 616-91-1 · N-Acetylcysteine · mercapturic acid · Acetadote · L-Acetylcysteine · Fluimucetin · Respaire · N-Acetyl cysteine · Acetilcisteina · Brunac · Acetylcysteinum · Syntemucol · Tixair
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
N-Acetyl-L-Cysteine — CAS 616-91-1

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

MolGod License & Provenance Record:
N-Acetyl-L-Cysteine (CAS 616-91-1) — License & Provenance

Source:
N-Acetyl-L-Cysteine (CAS 616-91-1) — MolGod molecule record

Source data: PubChem CID 12035

STL: Download 3D model (381 KB)

SHA-256: 342502d12819481188027d948986385ee4e15427ace50642faa209925d4727ac

Wikimedia Commons: not published yet

Source data: PubChem CID 12035

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