N,N-Diethyl-1,1,2,3,3,3-hexafluoropropylamine

HCID 136149CAS 309-88-6

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Grundinformationen

Standard-SMILES: CCN(CC)C(F)(F)C(F)C(F)(F)F
InChIKey: BNTFCVMJHBNJAR-UHFFFAOYSA-N
Summenformel: C7H11F6N
Durchschnittliche Molmasse: 223,16 g/mol
Monoisotopische Masse: 223,07956867

Namen und Bezeichner

Bevorzugter Name: N,N-Diethyl-1,1,2,3,3,3-hexafluoropropylamine
IUPAC: N,N-diethyl-1,1,2,3,3,3-hexafluoropropan-1-amine
Englischer Name: N,N-Diethyl-1,1,2,3,3,3-hexafluoropropylamine
Summenformel: C7H11F6N
Molmasse: 223.16

Namen und Synonyme

N,N-Diethyl-1,1,2,3,3,3-hexafluoropropylamineRefChem:822238628-698-8309-88-6Ishikawa's ReagentN,N-diethyl-1,1,2,3,3,3-hexafluoropropan-1-aminediethyl(1,1,2,3,3,3-hexafluoropropyl)amine1-Propanamine, N,N-diethyl-1,1,2,3,3,3-hexafluoro-N,N-Diethyl 1,1,2,3,3,3-hexafluoropropylamineN,N-diethyl-1,1,2,3,3,3-hexafluoro-1-propanamineMFCD00054683MEC-81

Weitere Namen anzeigen

IshikawaIshikawa ReagentISHIIshikawasUNII:N4Y8BIM7UDSHIKAWA'S REAGENTIshikawa’s Reagent

N,N-Diethyl-2H-perfluoropropanamineN4Y8BIM7UDN,N-Diethyl-1,1,2,3,3,3-hexafluoro-1-propylamineN-(1,1,2,3,3,3-hexafluoropropyl)diethylamineN,N-diethyl-1,1,2,3,3,3- hexafluoropropylamineISHIKAWA'S REAGANTUNII-N4Y8BIM7UD1,1,2,3,3,3-HEXAFLUORO-1-DIETHYLAMINOPROPANE

Datenbank-Bezeichner

CAS: 309-88-6
PubChem CID: 136149
DTXSID: DTXSID20880124
UNII: N4Y8BIM7UD
EC Number: 628-698-8
Nikkaji: J254.822D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,3
Polarare Oberfläche (TPSA): 3,2 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 7
Frei drehbare Bindungen: 4
Schwere Atome: 14
Formalladung: 0
Komplexität: 174

Experimentelle und physikochemische Eigenschaften

PFAS · 3 Einträge

PFAS -> Other/unspecified

PFAS -> OECD Category

PFAS -> Other/unspecified

Physikochemische Eigenschaften

Siedepunkt: 56 · 56-57 °C (lit.)
Dichte: 1.23 g/mL · 1.230 g/mL at 25 °C (lit.)
Brechungsindex: 1.346 · 1.3460
Flammpunkt: 56 · 56-57°C/58mm
storage temp.: Flammables area
Löslichkeit: soluble in Acetone,Ether
pka: 1.5 · 1.50±0.70(Predicted)
Aggregatzustand: Liquid
Farbe: Clear colorless to yellow
Wichte: 1.23 · 1.230
Merck: 14 · 14,5108
InChI: 1S/C7H11F6N/c1-3-14(4-2)7(12,13)5(8)6(9,10)11/h5H,3-4H2,1-2H3
InChIKey: BNTFCVMJHBNJAR-UHFFFAOYSA-N
SMILES: CCN(CC)C(F)(F)C(F)C(F)(F)F
CAS Datenbank: 309 · 309-88-6(CAS DataBase Reference)
EPA chemische Informationen: -2 H-perfluoropropanamine · N,N-Diethyl-2H-perfluoropropanamine (309-88-6)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H226 (89.6%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.