N-Methoxy-N-methylbenzamide

HCID 569575CAS 6919-61-5

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: CON(C)C(=O)c1ccccc1
InChIKey: UKERDACREYXSIV-UHFFFAOYSA-N
Summenformel: C9H11NO2
Durchschnittliche Molmasse: 165,19 g/mol
Monoisotopische Masse: 165,07897859

Überblick

N-methoxy-N-methylbenzamide is the Weinreb amide of benzoic acid.

Namen und Bezeichner

Bevorzugter Name: N-Methoxy-N-methylbenzamide
IUPAC: N-methoxy-N-methylbenzamide
Englischer Name: N-Methoxy-N-methylbenzamide
Summenformel: C9H11NO2
Molmasse: 165.19

Namen und Synonyme

N-Methoxy-N-methylbenzamide6919-61-5N-Methyl-N-methoxybenzamidemethyl N-methylbenzohydroxamateCHEBI:59742DTXSID80341044RefChem:163656DTXCID00292125805-987-9UKERDACREYXSIV-UHFFFAOYSA-NMFCD00075320N-methoxy-N-methyl-benzamide

Weitere Namen anzeigen

N-Methoxy-N-methylbenzamide >Methyl N-methylbenzohydroxamateN-Methoxy-N-methylbenzenecarboxamideN-Benzoyl-N-methyl-O-methylhydroxylamineN-Methylbenzohydroxamic acid methyl ester

N-methoxy-N-methylbenzamidN-Methoxy-N-methylbenzamide, 98%AKOS005259450CS-W017890SY052485M2672Q27126879Benzamide, N-methoxy-N-methyl-

Datenbank-Bezeichner

CAS: 6919-61-5
PubChem CID: 569575
DTXSID: DTXSID80341044
ChEBI: CHEBI:59742
EC Number: 805-987-9
Nikkaji: J314.503D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,7
Polarare Oberfläche (TPSA): 29,5 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 2
Schwere Atome: 12
Formalladung: 0
Komplexität: 153

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesChemical shift

Physikochemische Eigenschaften

Siedepunkt: 70 °C0.1 · 70 °C0.1 mm Hg(lit.)
Dichte: 1.085 g/mL · 1.085 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.533(lit.)
Flammpunkt: 230 °F · >230 °F
storage temp.: Sealed in dry,Room Temperature
Löslichkeit: Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand: Liquid
Farbe: Colorless to yellow
InChI: InChI=1S/C9H11NO2/c1-10(12-2)9(11)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKey: UKERDACREYXSIV-UHFFFAOYSA-N
SMILES: C(N(OC)C)(=O)C1=CC=CC=C1

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

This chemical does not meet GHS hazard criteria for 33.3% (1 of 3) of reports.

Warning

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (33.3%)

Sicherheitsdaten

wgk: 3
hs_code: 2928009090
Speicherklasse: 10 - Combustible liquids

Chemie und Industrie

Anwendungen · 1 Eintrag

VerwendenN-Methoxy-N-methylbenzamide is used to prepare orally bioavailable tetrasubstituted imidazoles as inhibitors of p38 mitogen-activated protein kinase. It is used to synthesize benzofuran and benzothiophene biphenyls as inhibitors of protein tyrosine phosphatase 1B with antihyperglycemic properties.