1,1,1,2,2-Pentafluoro-4-iodobutane (HCID 110092)

Namen und Bezeichner

Bevorzugter Name: 1,1,1,2,2-Pentafluoro-4-iodobutane
IUPAC: 1,1,1,2,2-pentafluoro-4-iodobutane
Lokaler Name: 1,1,1,2,2-Pentafluor-4-iodbutan
Englischer Name: 1,1,1,2,2-Pentafluoro-4-iodobutane
Summenformel: C4H4F5I
Molmasse: 273.97

Namen und Synonyme

1,1,1,2,2-Pentafluoro-4-iodobutane40723-80-6Butane, 1,1,1,2,2-pentafluoro-4-iodo-PR0N2JQF4XRefChem:1051643255-055-54-iodo-1,1,1,2,2-pentafluorobutane3,3,4,4,4-pentafluoro-1-iodobutaneMFCD001559102:2 Fluorotelomer iodide1-iodo-3,3,4,4,4-pentafluorobutane1,1,2,2-Tetrahydroperfluorobutyl iodide

Weitere Namen anzeigen

1H,1H,2H,2H-PERFLUOROBUTYL IODIDEuorobutane4-Iodo-1,1,1,2,2-pentafL1,1,1,2,2-pentafluoro-4-iodo-butan

2-Perfluoroethyl Ethyl IodideC4H4F5IEINECS 255-055-53,3,4,4,4-Pentafluorobutyl Iodideperfluoroethylethyl iodideUNII-PR0N2JQF4XCF3CF2CH2CH2ISCHEMBL323063

Datenbank-Bezeichner

CAS: 40723-80-6、68390-32-9、85995-91-1
PubChem CID: 110092
DTXSID: DTXSID8068250
UNII: PR0N2JQF4X
EC Number: 255-055-5、289-100-5
Nikkaji: J128.985C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,5
Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 2
Schwere Atome: 10
Formalladung: 0
Komplexität: 107

Experimentelle und physikochemische Eigenschaften

PFAS · 2 Einträge

PFAS -> Other/unspecified

Physikochemische Eigenschaften

Siedepunkt: 100 · 100-101 °C (lit.)
Dichte: 1.936 g/mL · 1.936 g/mL at 20 °C (lit.)
Brechungsindex: 20 · n20/D 1.391
Flammpunkt: 35 ℃ · 35℃
storage temp.: 2 · 2-8°C(protect from light)
Löslichkeit: soluble in Chloroform, Methanol
Aggregatzustand: clear liquid
Farbe: Colorless to Light yellow to Light orange
InChI: InChI=1S/C4H4F5I/c5-3(6,1-2-10)4(7,8)9/h1-2H2
InChIKey: PPXVPFPTMXFUDE-UHFFFAOYSA-N
SMILES: C(F)(F)(F)C(F)(F)CCI
CAS Datenbank: 40723 · 40723-80-6(CAS DataBase Reference)
EPA chemische Informationen: 1 · Butane, 1,1,1,2,2-pentafluoro-4-iodo- (40723-80-6)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Danger

H301 (95.3%): Toxic if swallowed [Danger Acute toxicity, oral]

P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

This chemical does not meet GHS hazard criteria for 100% (6 of 6) of all reports.

Not Classified

Gefahrenhinweise

Regulatory Information · 2 Einträge

S - indicates a substance that is identified in a final Significant New Use Rule.

Status: Cease Manufacture Update: 23-09-2010 https://echa.europa.eu/registration-dossier/-/registered-dossier/10801

Hazard Classes and Categories · 2 Einträge

Acute Tox. 3 (95.3%)

Not Classified

Sicherheitsdaten

F: 8
wgk: 2
tsca: TSCA listed
ridadr: UN 2810 6.1/PG 3
hs_code: 29037990
risk_code: 25-36
hazard_code: T
safety_code: 26-45
hazard_class: TOXIC
Speicherklasse: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
Hazard Classifications: Acute Tox. 3 OralEye Irrit. 2