Methylpyruvat

Methyl pyruvate

HCID 11748CAS 600-22-6
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Grundinformationen

Standard-SMILES
COC(=O)C(C)=O
InChIKey
CWKLZLBVOJRSOM-UHFFFAOYSA-N
Summenformel
C4H6O3
Durchschnittliche Molmasse
102,09 g/mol
Monoisotopische Masse
102,03169405

Überblick

Methyl pyruvate is a pyruvate ester resultinf grom the formal condensation of the carboxy group of pyruvic acid with the hydroxy group of methanol. It is a methyl ester and a pyruvate ester. It is functionally related to a pyruvic acid.

Namen und Bezeichner

Bevorzugter Name
Methyl pyruvate
IUPAC
methyl 2-oxopropanoate
Lokaler Name
Methylpyruvat
Englischer Name
Methyl pyruvate
Summenformel
C4H6O3
Molmasse
102.09

Namen und Synonyme

METHYL PYRUVATE600-22-6Methyl 2-oxopropanoateMethyl 2-oxopropionatePyruvic acid, methyl esterPropanoic acid, 2-oxo-, methyl esterMethylglyoxylic acid methyl ester2-oxo-propionic acid methyl ester3KJM65G5XLNSC-65430CHEBI:51850RefChem:818068
Weitere Namen anzeigen
PAMEMethyl acetoformateksbyPYR MEMethyl pyruyateMethylPyruvate>Methylpyruvate,96%
209-987-4MethylpyruvatePyruvic acid methyl estermethyl-PyruvateDTXSID9049326MFCD000087542-oxopropanoic acid methyl esterUNII-3KJM65G5XL

Datenbank-Bezeichner

CAS
600-22-6
PubChem CID
11748
DTXSID
DTXSID9049326
ChEMBL
CHEMBL3185405
ChEBI
CHEBI:51850
UNII
3KJM65G5XL
EC Number
209-987-4
Nikkaji
J483I

Eigenschaften

Berechnete Struktureigenschaften

XLogP
0
Polarare Oberfläche (TPSA)
43,4 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
2
Schwere Atome
7

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesChemical shift
Flavoring AgentsEU Flavoring substances

Physikochemische Eigenschaften

Schmelzpunkt
-22 °C · -22 °C
Siedepunkt
134 · 134-137 °C (lit.)
Dichte
1.13 g/mL · 1.13 g/mL at 25 °C (lit.)
Brechungsindex
20 · n20/D 1.404(lit.)
Flammpunkt
103 °F · 103 °F
storage temp.
2 · 2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H226 (92.3%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P271, P280, P303+P361+P353, P304+P340, P319, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 52 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Propanoic acid, 2-oxo-, methyl ester

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

Status: Active Update: 13-09-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/18742

Propanoic acid, 2-oxo-, methyl ester: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 3 (92.3%)

Sicherheitsdaten

F
10-21
wgk
3
ridadr
UN 3272 3/PG 3
hs_code
29183000
risk_code
10
hazard_code
Xi,F

Chemie und Industrie

Anwendungen · 1 Eintrag

VerwendenMethyl Pyruvate acts as a potent secretagogue used in the study of stimulus-secretion coupling. Also used in the preparation of quinoxalines as dual phoosphodiesterase 2/10 (PDE2/10) inhibitors. It increases free calcium ion concentration in the cytosol of pancreatic cells. It is used in the preparation of dimethyl 2,3-dimethylenebutanedioate.

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖北瑞泰医药科技有限公司15335880183

Ergänzende Hinweise

DefinitionChEBI: Methyl pyruvate is a pyruvate ester resultinf grom the formal condensation of the carboxy group of pyruvic acid with the hydroxy group of methanol. It is a pyruvate ester and a methyl ester. It derives from a pyruvic acid.

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