Diallylcarbamyl chloride

HCID 3449313

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Grundinformationen

CAS: 25761-72-2
Standard-SMILES: C=CCN(CC=C)C(=O)Cl
InChIKey: MGQPJLWKFQNTOZ-UHFFFAOYSA-N
Summenformel: C7H10ClNO
Durchschnittliche Molmasse: 159,61 g/mol
Monoisotopische Masse: 159,0450916

Namen und Bezeichner

Bevorzugter Name: Diallylcarbamyl chloride
IUPAC: N,N-bis(prop-2-enyl)carbamoyl chloride
Englischer Name: DIALLYLCARBAMYL CHLORIDE
Summenformel: C7H10ClNO
Molmasse: 159.61

Namen und Synonyme

Diallylcarbamyl chloride25761-72-2DTXSID60392574RefChem:586180DTXCID10343435624-311-1diallylcarbamic chlorideN,N-bis(prop-2-enyl)carbamoyl chlorideN,N-BIS(PROP-2-EN-1-YL)CARBAMOYL CHLORIDEMFCD02093718n,n-diallylcarbamoyl chloridediallylcarbamicchloride

Weitere Namen anzeigen

Diallylcarbamyl chloride 97%Carbamic chloride, N,N-di-2-propen-1-yl-DIALLYLCARBAMYL CHLORIDE ISO 9001：2015 REACH

diallylcarbamoyl chlorideSCHEMBL692534Diallylcarbamyl chloride, 97%MGQPJLWKFQNTOZ-UHFFFAOYSA-NAKOS022463789Di(prop-2-en-1-yl)carbamoyl chlorideN,N-di-2-propen-1-yl-carbamic chlorideLS-13287

Datenbank-Bezeichner

CAS: 25761-72-2
PubChem CID: 3449313
DTXSID: DTXSID60392574
EC Number: 624-311-1
Nikkaji: J1.972.820J

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,1
Polarare Oberfläche (TPSA): 20,3 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 4
Schwere Atome: 10
Formalladung: 0
Komplexität: 135

Physikochemische Eigenschaften

Siedepunkt: 214 · 214-220 °C(lit.)
Dichte: 1.069 g/mL · 1.069 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.48(lit.)
Flammpunkt: 86 °C · 86 °C
storage temp.: 2 · 2-8°C
InChI: 1S/C7H10ClNO/c1-3-5-9(6-4-2)7(8)10/h3-4H,1-2,5-6H2
InChIKey: MGQPJLWKFQNTOZ-UHFFFAOYSA-N
SMILES: ClC(=O)N(CC=C)CC=C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 2 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.