N-Methoxy-N-methylpropionamide

HCID 11344007CAS 104863-65-2

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Grundinformationen

Standard-SMILES: CCC(=O)N(C)OC
InChIKey: YKVJZSZZQKQJMO-UHFFFAOYSA-N
Summenformel: C5H11NO2
Durchschnittliche Molmasse: 117,15 g/mol
Monoisotopische Masse: 117,07897859

Namen und Bezeichner

Bevorzugter Name: N-Methoxy-N-methylpropionamide
IUPAC: N-methoxy-N-methylpropanamide
Englischer Name: N-METHOXY-N-METHYL-PROPIONAMIDE
Summenformel: C5H11NO2
Molmasse: 117.15

Namen und Synonyme

N-Methoxy-N-methylpropionamide104863-65-2DTXSID60462887RefChem:364351DTXCID90413706833-755-7N-methoxy-N-methylpropanamideN-METHOXY-N-METHYL-PROPIONAMIDEMFCD09833541N-methoxy-N-methyl-propanamideN-Methyl-N-methoxypropanamideSCHEMBL26558

Weitere Namen anzeigen

N-Methyl-N-MethoxypropionamidePropanamide, N-methoxy-N-methyl-

SCHEMBL209809SCHEMBL2722274N-Methoxy-N-methylisopropanamideYKVJZSZZQKQJMO-UHFFFAOYSA-NAR3350AKOS008953072propionic acid N-methoxy-N-methylamideDS-6631

Datenbank-Bezeichner

CAS: 104863-65-2
PubChem CID: 11344007
DTXSID: DTXSID60462887
EC Number: 833-755-7
Nikkaji: J2.348.513C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,2
Polarare Oberfläche (TPSA): 29,5 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 2
Schwere Atome: 8
Formalladung: 0
Komplexität: 82

Physikochemische Eigenschaften

Siedepunkt: 119 · 119.0±23.0 °C(Predicted)
Dichte: 0.961 · 0.961±0.06 g/cm3(Predicted)
Brechungsindex: 1.427 to · 1.4270 to 1.4310
Flammpunkt: 26 ° · 26°
storage temp.: 2 · 2-8°C
Löslichkeit: Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand: clear liquid
Farbe: Colorless to Almost colorless
InChI: InChI=1S/C5H11NO2/c1-4-5(7)6(2)8-3/h4H2,1-3H3
InChIKey: YKVJZSZZQKQJMO-UHFFFAOYSA-N
SMILES: C(N(OC)C)(=O)CC

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H225 (33.3%): Highly Flammable liquid and vapor [Danger Flammable liquids]；H226 (66.7%): Flammable liquid and vapor [Warning Flammable liquids]；H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.