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3-Bromopyruvic acid

CAS 1113-59-3C3H3BrO3MW 166.96

3-Bromopyruvic acid (CAS 1113-59-3) — formula C3H3BrO3, molecular weight 166.96; category organic chemicals.

Product Overview

CAS Number1113-59-3
Molecular FormulaC3H3BrO3
Molecular Weight166.96
LogP0.5
CategoryOrganic Chemicals

Technical Profile

What this product is

3-Bromopyruvic acid is a carbon-based organic compound with CAS registry number 1113-59-3 and molecular formula C3H3BrO3 (molecular weight 166.96), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 1113-59-3

Its molecular formula C3H3BrO3 comprises 3 C, 3 H, 1 Br, 3 O atoms.

Also known as: 3-Bromopyruvic acid

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of 3-Bromopyruvic acid?

The CAS registry number of 3-Bromopyruvic acid is 1113-59-3.

What is the molecular formula and molecular weight of 3-Bromopyruvic acid?

Molecular formula C3H3BrO3, molecular weight 166.96.

What other names is 3-Bromopyruvic acid known by?

It is also registered under: 3-Bromopyruvic acid.

Which category does 3-Bromopyruvic acid belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for 3-Bromopyruvic acid (CAS 1113-59-3), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number1113-59-3
PubChem CID70684
Molecular formulaC3H3BrO3
IUPAC name3-bromo-2-oxopropanoic acid
UNII (FDA)63JMV04GRK

Computed descriptors

Molecular Weight166.96
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass165.92656
Monoisotopic Mass165.92656
Topological Polar Surface Area54.4
Heavy Atom Count7

Documented uses on record

    Propanoic acid, 3-bromo-2-oxo-: ACTIVEAnalogs of those substrates or compounds which bind naturally at the active sites of proteins, enzymes, antibodies, steroids, or physiological receptors. These analogs form a stable covalent bond at the binding site, thereby acting as inhibitors of the proteins or steroids.

    Synonyms and trade names

    bromopyruvic acid; 3-bromopyruvic acid; 1113-59-3; 3-bromo-2-oxopropanoic acid; bromopyruvate; 3-Bromo-2-oxopropionic acid; 63JMV04GRK; DTXSID7040940; NSC-11731; NSC-62343; CHEBI:131461; 3-BrPA cpd; RefChem:499406; DTXCID5020940; 214-206-5; 3-bromopyruvate

    GHS hazard classification

    Reported hazard statementsH314 (100%)

    H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

    P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

    What the public record says

    3-Bromopyruvic acid · CAS 1113-59-3 · C3H3BrO3. UNII 63JMV04GRK.

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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