Carbonochloridic acid, 2-fluoroethyl ester

HCID 10017

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Grundinformationen

CAS: 462-27-1
Standard-SMILES: O=C(Cl)OCCF
InChIKey: FOHSVPIFZASOED-UHFFFAOYSA-N
Summenformel: C3H4ClFO2
Durchschnittliche Molmasse: 126,51 g/mol
Monoisotopische Masse: 125,9883852

Namen und Bezeichner

Bevorzugter Name: Carbonochloridic acid, 2-fluoroethyl ester
IUPAC: 2-fluoroethyl carbonochloridate
Englischer Name: 2-FLUOROETHYL CHLOROFORMATE
Summenformel: C3H4ClFO2
Molmasse: 126.51

Namen und Synonyme

2-Fluoroethyl chloroformateCarbonochloridic acid, 2-fluoroethyl esterChloroformic acid 2-fluoroethyl esterTL 751BRN 17466552-Fluorethylester kyseliny chlormravenci [Czech]2-Fluorethylester kyseliny chlormravenciCarbonochloridic acid, 2-fluoroethyl ester (9CI)Formic acid, chloro-, 2-fluoroethyl ester4-03-00-00024 (Beilstein Handbook Reference)DTXSID50196760RefChem:123619

Weitere Namen anzeigen

tl7512-Fluoroethyl chloroforMate 97%chloroformicacid2-fluoroethylesterchloro-formicaci2-fluoroethylesterformicacid,chloro-,2-fluoroethylester2-fluorethylesterkyselinychlormravencichlorocarbonic acid 2-fluoroethyl estercarbonochloridicacid,2-fluoroethylester

DTXCID90119251624-170-6462-27-12-fluoroethyl carbonochloridateMFCD01726287C3H4ClFO22-Fluorathyl-chlorcarbonat2-fluoroethyl chlorocarbonate

Datenbank-Bezeichner

CAS: 462-27-1
PubChem CID: 10017
DTXSID: DTXSID50196760
EC Number: 624-170-6
Nikkaji: J69.672B

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,5
Polarare Oberfläche (TPSA): 26,3 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 3
Schwere Atome: 7
Formalladung: 0
Komplexität: 66

Physikochemische Eigenschaften

Siedepunkt: 131 · 131-135 °C (lit.)
Dichte: 1.34 g/mL · 1.34 g/mL at 25 °C (lit.)
Dampfdruck: 0.83 mm · 0.83 mm Hg ( 20 °C)
Brechungsindex: 20 · n20/D 1.4(lit.)
Flammpunkt: 138 °F · 138 °F
storage temp.: 2 · 2-8°C
Löslichkeit: Chloroform (Slightly), Ethyl Acetate (Slightly)
Aggregatzustand: Oil
Farbe: Colourless
Stabilität: Hygroscopic, Moisture Sensitive, Very Volatile
InChI: 1S/C3H4ClFO2/c4-3(6)7-2-1-5/h1-2H2
InChIKey: FOHSVPIFZASOED-UHFFFAOYSA-N
SMILES: FCCOC(Cl)=O

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H331 (100%): Toxic if inhaled [Danger Acute toxicity, inhalation]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 1 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.