Bromopyruvic Acid

CAS 1113-59-3  ·  C3H3BrO3  ·  MW 166.96 g/mol

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3D model Bromopyruvic Acid, CAS 1113-59-3, molecular formula C3H3BrO3, molar mass 166.96 g/mol
About Bromopyruvic Acid

Bromopyruvic Acid is a chemical compound registered under number CAS 1113-59-3, with the molecular formula C3H3BrO3, and a molar mass of 166.96 g/mol.

The molecule contains 10 atoms connected by 9 chemical bonds. The full systematic IUPAC name of this compound is 3-bromo-2-oxopropanoic 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 = 0.5 (positive value, a lipophilic compound), polar surface area PSA = 54.4 Ų, 1 donors and 3 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 formulaC3H3BrO3
Masa molowa166.96 g/mol
IUPAC3-bromo-2-oxopropanoic acid
SMILESC(C(=O)C(=O)O)Br
InChIKeyPRRZDZJYSJLDBS-UHFFFAOYSA-N
logP (XLogP3)0.5
PSA54.4 Ų
HBD / HBA1 / 3
PubChem CIDCID 70684 ↗
GHS safety

Signal word: Danger

GHS05
GHS05

H314 — Powoduje poważne oparzenia skóry oraz uszkodzenia oczu

Scientific literature

Related literature

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

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

📈 Publication timeline (10 articles)

2004: 1 articles20042012: 2 articles2013: 1 articles2017: 1 articles2020: 1 articles20202021: 1 articles2023: 1 articles2025: 2 articles2025

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
bromopyruvic acid · 3-bromopyruvic acid · 1113-59-3 · 3-bromo-2-oxopropanoic acid · bromopyruvate · 3-Bromo-2-oxopropionic acid · 63JMV04GRK · NSC-11731 · NSC-62343 · CHEBI:131461 · 3-BrPA cpd · RefChem:499406 · DTXCID5020940 · 214-206-5 · 3-bromopyruvate
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
Bromopyruvic Acid — CAS 1113-59-3

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

MolGod License & Provenance Record:
Bromopyruvic Acid (CAS 1113-59-3) — License & Provenance

Source:
Bromopyruvic Acid (CAS 1113-59-3) — MolGod molecule record

Source data: PubChem CID 70684

STL: Download 3D model (199 KB)

SHA-256: 59fb1d38ca2a3d22b2aa8208b34964cf772709b938f2cb04306ae871cea8ba81

Wikimedia Commons: not published yet

Source data: PubChem CID 70684

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