Diethylchlorphosphit

Ethyl phosphorochloridite

HCID 68530CAS 589-57-1

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Grundinformationen

Standard-SMILES: CCOP(Cl)OCC
InChIKey: TXHWYSOQHNMOOU-UHFFFAOYSA-N
Summenformel: C4H10ClO2P
Durchschnittliche Molmasse: 156,55 g/mol
Monoisotopische Masse: 156,01069387

Namen und Bezeichner

Bevorzugter Name: Ethyl phosphorochloridite
IUPAC: chloro(diethoxy)phosphane
Lokaler Name: Diethylchlorphosphit
Englischer Name: DIETHYL CHLOROPHOSPHITE
Summenformel: C4H10ClO2P
Molmasse: 156.55

Namen und Synonyme

Diethyl chlorophosphite589-57-1Diethyl phosphorochloriditeEthyl phosphorochloriditeChlorodiethoxyphosphinePhosphorochloridous acid, diethyl esterEthyl chlorophosphitediethylchlorophosphonitePhosphorochloridous acid diethyl esterF414S3V8K6EINECS 209-652-2DIETHOXYCHLOROPHOSPHINE

Weitere Namen anzeigen

orophosphiteAURORA KA-1221dlethylchlorophosphiteChlorodiethyl phosphiteDiethyl chloridophosphite

DTXSID0060430DIETHYL PHOSPHOROCHLORIDITE [MI]RefChem:596378DTXCID1042493209-652-2InChI=1/C4H10ClO2P/c1-3-6-8(5)7-4-2/h3-4H2,1-2Hchloro(diethoxy)phosphanediethylchlorophosphite

Datenbank-Bezeichner

CAS: 589-57-1
PubChem CID: 68530
DTXSID: DTXSID0060430
UNII: F414S3V8K6
EC Number: 209-652-2
Nikkaji: J6.751B

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,5
Polarare Oberfläche (TPSA): 18,5 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 4
Schwere Atome: 8
Formalladung: 0
Komplexität: 47,3

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesOptical coefficient

Physikochemische Eigenschaften

Schmelzpunkt: 25 °C · 25°C
Siedepunkt: 153 · 153-155 °C (lit.) 56-57.5 °C/30 mmHg (lit.)
Dichte: 1.089 g/mL · 1.089 g/mL at 20 °C (lit.)
Brechungsindex: 20 · n20/D 1.434(lit.)
Flammpunkt: 34 °F · 34 °F
storage temp.: 2 · 2-8°C
Löslichkeit: Chloroform (Slightly), Ethyl Acetate (Slightly)
Aggregatzustand: Liquid
Farbe: Clear colorless to yellow
Wasserlöslichkeit: Soluble in DMSO and chloroform. Reacts with water.
Merck: 14 · 14,3841
BRN: 1098392 · 1098392
Stabilität: Air and Moisture Sensitive
InChI: 1S/C4H10ClO2P/c1-3-6-8(5)7-4-2/h3-4H2,1-2H3
InChIKey: TXHWYSOQHNMOOU-UHFFFAOYSA-N
SMILES: CCOP(Cl)OCC
CAS Datenbank: 589 · 589-57-1(CAS DataBase Reference)
EPA chemische Informationen: Phosphorochloridous acid, diethyl ester (589-57-1)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H225 (91.1%): Highly Flammable liquid and vapor [Danger Flammable liquids]

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, P319, P321, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory InformationChemical: Phosphorochloridous acid, diethyl ester

Hazard Classes and CategoriesFlam. Liq. 2 (91.1%)

Sicherheitsdaten

F: 10-21
wgk: 3
tsca: TSCA listed
ridadr: UN 2924 3/PG 2
hs_code: 29209085
risk_code: 11-14-34-37
hazard_code: F,C
safety_code: 16-26-36/37/39-45-7/8
hazard_class: 3
packing_group: II
Speicherklasse: 3 - Flammable liquids
Hazard Classifications: Flam. Liq. 2Skin Corr. 1BSTOT SE 3

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationPhosphorochloridous acid, diethyl ester: ACTIVE

Anwendungen

VerwendenDiethyl Chlorophosphite is used in the synthesis of organophosphates and are considered anticholinesterase agents through observation in studies.