N-Cyclohexylacetoacetamid

N-Cyclohexylacetoacetamide

HCID 70805CAS 1132-42-9

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: CC(=O)CC(=O)NC1CCCCC1
InChIKey: FLCPERRDPXWFDK-UHFFFAOYSA-N
Summenformel: C10H17NO2
Durchschnittliche Molmasse: 183,25 g/mol
Monoisotopische Masse: 183,12592879

Namen und Bezeichner

Bevorzugter Name: N-Cyclohexylacetoacetamide
IUPAC: N-cyclohexyl-3-oxobutanamide
Lokaler Name: N-Cyclohexylacetoacetamid
Englischer Name: N-cyclohexylacetoacetamide
Summenformel: C10H17NO2
Molmasse: 183.25

Namen und Synonyme

N-Cyclohexylacetoacetamiden-cyclohexyl-3-oxobutanamide1132-42-9Butanamide, N-cyclohexyl-3-oxo-V4R6MJY84BEINECS 214-475-9NSC-60220DTXSID60150318NSC 60220RefChem:163155DTXCID0072809214-475-9

Weitere Namen anzeigen

N-Cyclohexyl-3-oxobutyramide

Butanamide,N-cyclohexyl-3-oxo-acetoacetic cyclohexylamideNSC60220UNII-V4R6MJY84BN-cyclohexyl-acetylacetamideN-cyclohexyl-3-oxo-butanamideSCHEMBL2413616AKOS000165977

Datenbank-Bezeichner

CAS: 1132-42-9
PubChem CID: 70805
DTXSID: DTXSID60150318
UNII: V4R6MJY84B
EC Number: 214-475-9
Nikkaji: J203.379H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,8
Polarare Oberfläche (TPSA): 46,2 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 3
Schwere Atome: 13
Formalladung: 0
Komplexität: 195

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.；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.