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Home/Compounds/CAS 816-66-0
Formula C6H10O3MW 130.14Research-use catalog entryCOA/SDS by request

4-Methyl-2-oxovaleric acid

CAS Number: 816-66-0

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Loading RDKit molecule structure...
InChIKey: BKAJNAXTPSGJCU-UHFFFAOYSA-NC6H10O3 | MW 130.14

Chemical Absolute Identifiers

CAS Number

816-66-0

PubChem CID

70

Molecular Formula

C6H10O3

Molecular Weight

130.14 g/mol

Exact Mass

130.062994

InChIKey

BKAJNAXTPSGJCU-UHFFFAOYSA-N

IUPAC Name

4-methyl-2-oxopentanoic acid

SMILES String

CC(C)CC(=O)C(=O)O

Physical Properties

Melting Point

8–1 °C

Boiling Point

251.0 °C

Density

1.05 g/cm³

Water Solubility

32 mol/L

Show more physical data

Refractive Index

1.432

Properties are provided as catalog reference data and may be confirmed through supplier documentation when required.

Catalog Facts

Structural features

4-Methyl-2-oxovaleric acid (CAS 816-66-0) is listed in the Advanced Chemicals portfolio, with molecular formula C6H10O3 and molecular weight 130. 14 g/mol.

Sourcing context

Catalog reference for RFQ preparation, supplier confirmation, and research chemical sourcing review.

Research use context

Intended for research building-block and synthetic chemistry workflows.

Documentation needs

COA/SDS status, availability, lead time, pack size, and shipment documentation can be confirmed during quotation.

Applications & Classification

Natural Product ResearchSynthetic ChemistryResearch intermediateCustom synthesis building blockResearch chemical sourcingCustom synthesis and catalog availability reviewCOA, SDS, pricing, and fulfillment workflow
Biological target reference

ChEMBL reports experimental activity evidence for: Monocarboxylate transporter 1 (Rattus norvegicus) — 2 assays. These records describe research assays and do not establish therapeutic efficacy or clinical use.

Monocarboxylate transporter 1

Rattus norvegicus · SINGLE PROTEIN · 2 qualifying assays · 2 documents

Experimental evidence source: ChEMBL

Safety & Handling

Safety and handling reference content is available through documentation requests.

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Preliminary Safety Reference

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Safety Reference / SDS Request

Names & Synonyms / External Identifiers

Chemical Name

4-Methyl-2-oxovaleric acid

Names & Synonyms

alpha-Ketoisocaproic acid2-OXO-4-METHYLPENTANOIC ACID2-Oxoisocaproate2-Oxoisocaproic acid4-methyl-2-oxopentanoate
Show all synonyms
Pentanoic acid, 4-methyl-2-oxo-alpha-oxoisocaproate2-Oxoleucine2-ketoisocaproate2-Oxo-4-methylvaleric acid2-oxo-4-methylpentanoatealpha-keto-isocaproic acid2-keto-4-Methylvaleric acidKetoleucinealpha-ketoisocaproate4-methyl-2-oxo-pentanoic acid2-Oxoisohexanoate.alpha.-Ketoisocaproic acid2-KETOISOCAPROIC ACID
External Identifiers
EC NUMBER: 212-435-5DSSTOX SUBSTANCE ID: DTXSID6061157CHEMBL ID: CHEMBL445647CHEBI ID: CHEBI:48430UNII: 4GUJ8AH400DRUGBANK ID: DB03229HMDB ID: HMDB0000695KEGG ID: C00233METABOLOMICS WORKBENCH ID: 37370WIKIDATA ID: Q622421
Experimental Spectrum References
13C NMR Spectra1H NMR SpectraNear IR Spectra — Prof. Buback, University of Goettingen, GermanyRaman Spectra
Literature & Patent References
DOI 10.1111/j.1469-7793.2000.00285.xCharacterisation of human monocarboxylate transporter 4 substantiates its role in lactic acid efflux from skeletal muscle.PMID 11101640Characterisation of human monocarboxylate transporter 4 substantiates its role in lactic acid efflux from skeletal muscle.DOI 10.1042/0264-6021:3410529Characterization of the high-affinity monocarboxylate transporter MCT2 in Xenopus laevis oocytes.PMID 10417314Characterization of the high-affinity monocarboxylate transporter MCT2 in Xenopus laevis oocytes.DOI 10.1042/bj3330167Characterization of the monocarboxylate transporter 1 expressed in Xenopus laevis oocytes by changes in cytosolic pH.PMID 9639576Characterization of the monocarboxylate transporter 1 expressed in Xenopus laevis oocytes by changes in cytosolic pH.DOI 10.1074/jbc.272.48.30096Comparison of lactate transport in astroglial cells and monocarboxylate transporter 1 (MCT 1) expressing Xenopus laevis oocytes. Expression of two different monocarboxylate transporters in astroglial cells and neurons.PMID 9374487Comparison of lactate transport in astroglial cells and monocarboxylate transporter 1 (MCT 1) expressing Xenopus laevis oocytes. Expression of two different monocarboxylate transporters in astroglial cells and neurons.

Documentation & Compliance Facts

Compliance Facts

Shipment review: Required

Documentation available by request

Certificate of Analysis (COA): By request

Supplier Safety Data Sheet (SDS): By request

Purity and pack size confirmation: By request

Availability and lead time review: Confirmed by RFQ

Shipment documentation review: By request

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What happens after RFQ

  1. 1We review the CAS identity, quantity, and documentation request.
  2. 2We check sourcing options, supplier availability, COA/SDS, purity, pack size, and lead time.
  3. 3We review destination and shipment documentation needs when applicable.
  4. 4We follow up with a quotation or clarification request.

Text Reference Cues

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Non-public related references

1,2,3-Propanetricarboxylic acidCAS 99-14-9
Tiglic acidCAS 80-59-1
4-HydroxyisoleucineCAS 781658-23-9
Glycyl-L-valineCAS 1963-21-9
3-(Methylthio)propanoic acidCAS 646-01-5

Non-public references are shown as text only and do not imply equivalence, availability, or shared use.

Catalog navigation

Related Catalog Entries

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.

CAS 1002310-00-0Tert-butyl 1-(2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)ethylcarbamateCAS 1005174-17-3(E)-3-(2-Propyl-6-(trifluoromethyl)pyridin-3-yl)acrylic acidCAS 1018125-49-92-(3-Cyclopropyl-6-ethyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acidCAS 1018128-07-8Isopropyl 4-chloro-2-methylquinoline-6-carboxylateCAS 1018142-22-76-cyclopropyl-1-(2,2-difluoroethyl)-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acidCAS 1018144-00-72-(3-Cyclopropyl-6-isopropyl-4-(trifluoromethyl)-1H-pyrazolo[3,4-b]pyridin-1-yl)acetic acid

RFQ questions for CAS 816-66-0

What are the key identifiers for 4-Methyl-2-oxovaleric acid (CAS 816-66-0)?

4-Methyl-2-oxovaleric acid is identified by CAS 816-66-0, with molecular formula C6H10O3, molecular weight 130.14, InChIKey BKAJNAXTPSGJCU-UHFFFAOYSA-N.

Does CAS 816-66-0 have reported biological target evidence?

ChEMBL contains qualifying experimental assay evidence associated with Monocarboxylate transporter 1. These records do not establish therapeutic efficacy or clinical use.

Can I request a COA for CAS 816-66-0?

Yes. Submit an RFQ and specify COA requirements. Lot-specific COA depends on supplier confirmation.

Can I request supplier SDS for 4-Methyl-2-oxovaleric acid?

Yes. Supplier SDS can be requested through the RFQ workflow before handling, storage, shipment, or procurement decisions.

Is CAS 816-66-0 available for quotation?

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