2-Chlorethylethylether

Ethane, 1-chloro-2-ethoxy-

HCID 12341CAS 628-34-2

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Grundinformationen

Standard-SMILES: CCOCCCl
InChIKey: GPTVQTPMFOLLOA-UHFFFAOYSA-N
Summenformel: C4H9ClO
Durchschnittliche Molmasse: 108,57 g/mol
Monoisotopische Masse: 108,03419259

Namen und Bezeichner

Bevorzugter Name: Ethane, 1-chloro-2-ethoxy-
IUPAC: 1-chloro-2-ethoxyethane
Lokaler Name: 2-Chlorethylethylether
Englischer Name: 2-Chloroethyl ethyl ether
Summenformel: C4H9ClO
Molmasse: 108.57

Namen und Synonyme

2-Chloroethyl ethyl ether1-CHLORO-2-ETHOXYETHANE2-Ethoxyethyl chloride2-ChloroethoxyethaneEthane, 1-chloro-2-ethoxy-Ether, 2-chloroethyl ethylbeta-Chloroethyl ethyl etherEthyl beta-chloroethyl etherCCRIS 9095EINECS 211-037-9BRN 1731361DTXSID10211882

Weitere Namen anzeigen

2-OxyalkylChlorideEthoxyethyl chloride2-chloro-ethyl ether B1-chloro-2-ethoxy-ethanether,2-chloroethylethyl

RefChem:591653DTXCID40134373Ethane, 1-chloro-2-ethoxy-(9CI)211-037-9628-34-22-Chloroethylethylether1-chloro-2-ethoxy-ethane2-Chlorodiethyl ether

Datenbank-Bezeichner

CAS: 628-34-2
PubChem CID: 12341
DTXSID: DTXSID10211882
UNII: 2NLQ3AZ36L
EC Number: 211-037-9
Nikkaji: J1.699C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1
Polarare Oberfläche (TPSA): 9,2 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 3
Schwere Atome: 6
Formalladung: 0
Komplexität: 23,5

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesBoiling point

LogP0.98

Physikochemische Eigenschaften

Schmelzpunkt: -60 °C · -60 °C
Siedepunkt: 107 °C · 107 °C(lit.)
Dichte: 0.989 g/mL · 0.989 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.411(lit.)
Flammpunkt: 60 °F · 60 °F
storage temp.: Flammables area
Aggregatzustand: clear liquid
Farbe: Colorless to Almost colorless
Wasserlöslichkeit: miscible
BRN: 1731361 · 1731361
InChI: InChI=1S/C4H9ClO/c1-2-6-4-3-5/h2-4H2,1H3
InChIKey: GPTVQTPMFOLLOA-UHFFFAOYSA-N
SMILES: C(Cl)COCC
CAS Datenbank: 628 · 628-34-2(CAS DataBase Reference)
NIST chemische Informationen: 1 · 1-Chloro-2-ethoxyethane(628-34-2)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information2-Ethoxyethyl chloride: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 2 (100%)

Sicherheitsdaten

F: 9
wgk: 3
ridadr: UN 1992 3/PG 2
hs_code: 29091900
RTECS-Nr.: KN6250000
risk_code: 11-20/22-41-36/37/38-2011/10/11
hazard_code: F,Xn
safety_code: 36/37-37/39-26-16
hazard_class: 3
packing_group: II
Speicherklasse: 3 - Flammable liquids
Hazard Classifications: Acute Tox. 3 InhalationAcute Tox. 3 OralFlam. Liq. 2

Chemie und Industrie

Anwendungen · 1 Eintrag

VerwendenIt is used as a pharmaceutical intermediate. Photocatalytic oxidation of gaseous 2-chloroethyl ethyl sulfide over TiO2 illuminated with UV light and maintained at 25 or 80°C in air was found to suffer progressive oxidation to yield ethylene, chloroethylene , ethanol, acetaldehyde, chloroacetaldehyde, diethyl disulfide, 2-chloroethyl ethyl disulfide and bis(2-chloroethyl) disulfide as the main primary intermediates, and water (H2O), carbon dioxide (CO2), sulfur dioxide (SO2), surface sulfate ions (SO42-), and hydrogen chloride (HCl) as the final products.