N-(n-Propyl) acrylamide

HCID 114794CAS 25999-13-7

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Grundinformationen

Standard-SMILES: C=CC(=O)NCCC
InChIKey: WDFKEEALECCKTJ-UHFFFAOYSA-N
Summenformel: C6H11NO
Durchschnittliche Molmasse: 113,16 g/mol
Monoisotopische Masse: 113,08406397

Namen und Bezeichner

Bevorzugter Name: N-(n-Propyl) acrylamide
IUPAC: N-propylprop-2-enamide
Englischer Name: N-Propylacrylamide
Summenformel: C6H11NO
Molmasse: 113.16

Namen und Synonyme

N-(n-Propyl) AcrylamideRefChem:828516696-278-1n-propylacrylamide25999-13-7n-propylprop-2-enamide2-Propenamide, N-propyl-MFCD00080629N-n-propylacrylamideN-propyl acrylamideN-Propylacrylamide (stabilized with MEHQ)SCHEMBL141762

Weitere Namen anzeigen

N-npropyleneamide

SCHEMBL252047SCHEMBL748185SCHEMBL2656608SCHEMBL6611303SCHEMBL10355724DTXSID30276150ABA99913AB9941

Datenbank-Bezeichner

CAS: 25999-13-7
PubChem CID: 114794
DTXSID: DTXSID30276150
EC Number: 696-278-1
Nikkaji: J107.683C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1
Polarare Oberfläche (TPSA): 29,1 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 3
Schwere Atome: 8
Formalladung: 0
Komplexität: 88

Physikochemische Eigenschaften

Siedepunkt: 234.2 · 234.2±13.0 °C(Predicted)
Dichte: 0.879 · 0.879±0.06 g/cm3(Predicted)
storage temp.: -20 °C · -20°C
Aggregatzustand: liquid
pka: 15.12 · 15.12±0.46(Predicted)
Farbe: colorless to pale yellow
InChI: 1S/C6H11NO/c1-3-5-7-6(8)4-2/h4H,2-3,5H2,1H3,(H,7,8)
InChIKey: WDFKEEALECCKTJ-UHFFFAOYSA-N

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (50%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (50%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 4 reports by companies from 4 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.