2,2,2-Trichlorethylchlorformiat

2,2,2-Trichloroethyl chloroformate

HCID 87063CAS 17341-93-4
TeilstruktursucheÄhnliche Strukturen suchen

Grundinformationen

Standard-SMILES
O=C(Cl)OCC(Cl)(Cl)Cl
InChIKey
LJCZNYWLQZZIOS-UHFFFAOYSA-N
Summenformel
C3H2Cl4O2
Durchschnittliche Molmasse
211,9 g/mol
Monoisotopische Masse
209,88089002

Überblick

reagent for gas chromatographic analysis of pethidine; structure

Namen und Bezeichner

Bevorzugter Name
2,2,2-Trichloroethyl chloroformate
IUPAC
2,2,2-trichloroethyl carbonochloridate
Lokaler Name
2,2,2-Trichlorethylchlorformiat
Englischer Name
2,2,2-Trichloroethyl chloroformate
Summenformel
C3H2Cl4O2
Molmasse
211.86

Namen und Synonyme

2,2,2-Trichloroethyl chloroformate17341-93-4Trichloroethyl chloroformateCarbonochloridic acid, 2,2,2-trichloroethyl ester2,2,2-Trichloroethoxycarbonyl chloride99UY6LZN4RNSC-152038DTXSID3066188RefChem:900652DTXCID5035539241-363-72,2,2-trichloroethyl carbonochloridate
Weitere Namen anzeigen
2,2,2-Trichloroethyltrichloroethylchloroformate(Trichloroethoxy)chloroformate2,2,2 TRI CHLOROETHYL CHLOROFORMAT2,2,2-trichloroethyl chlorocarbonate
2,2,2-trichloroethylchloroformateTroc-ClMFCD00000810Chloroformic acid 2,2,2-trichloroethyl esterFormic acid, chloro-, 2,2,2-trichloroethyl ester2,2,2-trichloroethylchloranuidylformatebeta,beta,beta-trichloroethyl chloroformatetrichloroethoxycarbonyl chloride

Datenbank-Bezeichner

CAS
17341-93-4
PubChem CID
87063
DTXSID
DTXSID3066188
UNII
99UY6LZN4R
EC Number
241-363-7
Nikkaji
J42.326B

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3
Polarare Oberfläche (TPSA)
26,3 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
2
Schwere Atome
9

Experimentelle und physikochemische Eigenschaften

Chemical ClassesToxic Gases & Vapors -> Acid Halides
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Vapor Pressure3.1 [mmHg]
Physical DescriptionLight yellow liquid; [Sigma-Aldrich MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
1 °C · 1°C
Siedepunkt
171 · 171-172 °C (lit.)
Dichte
1.539 g/mL · 1.539 g/mL at 25 °C (lit.)
Dampfdruck
0.06 psi · 0.06 psi ( 20 °C)
Brechungsindex
20 · n20/D 1.471(lit.)
Flammpunkt
100 °C · >100°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H302 (17%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P271, P280, P284, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P320, P321, P330, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 53 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: Carbonochloridic acid, 2,2,2-trichloroethyl ester

Carbonochloridic acid, 2,2,2-trichloroethyl ester: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationEvaluation - Chemicals that are unlikely to require further regulation to manage risks to human health
Hazards SummaryCauses burns and lachrymation; Inhalation may cause corrosive injuries to upper respiratory tract; Toxic by inhalation; [Sigma-Aldrich MSDS] See CHLOROFORMATES.
Hazard Classes and CategoriesAcute Tox. 4 (17%)

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.

Sicherheitsdaten

F
10-19
wgk
3
tsca
TSCA listed
ridadr
UN 3277 6.1/PG 2
hs_code
29159000
risk_code
23-34-36

Chemie und Industrie

Verwendung und Herstellung

UsesReagent for gas chromatographic analysis of pethidine. [ChemIDplus]
General Manufacturing InformationCarbonochloridic acid, 2,2,2-trichloroethyl ester: ACTIVE
Anwendungen · 1 Eintrag

Verwenden2,2,2-Trichloroethyl chloroformate is used as a protecting reagent for aliphatic and aromatic hydroxyl and amino groups. It is used as derivatizing reagent in gas chromatographic/mass spectrometric determination of a large range of amphetamine-related drugs and ephedrines in plasma, urine and hair samples, during N-demethylation of dextromethorphan. It was used as starting reagent during the synthesis of 6-Nor-9,10-dihydrolysergic acid methyl ester.

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]

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