1,1,1,3-Tetrachlorpropan

1,1,1,3-Tetrachloropropane

HCID 14056CAS 1070-78-6

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Grundinformationen

Standard-SMILES: ClCCC(Cl)(Cl)Cl
InChIKey: UTACNSITJSJFHA-UHFFFAOYSA-N
Summenformel: C3H4Cl4
Durchschnittliche Molmasse: 181,9 g/mol
Monoisotopische Masse: 179,90671085

Überblick

an intermediate in the production of chlorinated silicone fluids

Namen und Bezeichner

Bevorzugter Name: 1,1,1,3-Tetrachloropropane
IUPAC: 1,1,1,3-tetrachloropropane
Lokaler Name: 1,1,1,3-Tetrachlorpropan
Englischer Name: 1,1,1,3-Tetrachloro-propane
Summenformel: C3H4Cl4
Molmasse: 181.88

Namen und Synonyme

1,1,1,3-Tetrachloropropane1070-78-6PROPANE, 1,1,1,3-TETRACHLORO-DM99MQP76VDTXSID8051546RefChem:70837DTXCID90300981,1,1,3-TCP213-981-71,1,1,3-Tetrachloro-propaneMFCD00054655BRN 1734994

Weitere Namen anzeigen

HCC-250fbTetrachloropropane1,1,1,3-TetrachlorpropanTetrachloropropane/250fb1,1,1,3-tetrachloro-propanpropane,1,1,1,3-tetrachloro-1,1,1,3-Tetrachloropropane (HC-250fb) 98%1,1,1,3-Tetrachloro-propaneTetrachlorpropan

EINECS 213-981-71,1,1,3-Tetrachloropropane (HC-250fb)UNII-DM99MQP76V4-01-00-00201 (Beilstein Handbook Reference)SCHEMBL432042SCHEMBL5398672SCHEMBL9631271BAA07078

Datenbank-Bezeichner

CAS: 1070-78-6
PubChem CID: 14056
DTXSID: DTXSID8051546
UNII: DM99MQP76V
EC Number: 213-981-7
Nikkaji: J35.469D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3
Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 0
Frei drehbare Bindungen: 1
Schwere Atome: 7
Formalladung: 0
Komplexität: 45,4

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesBoiling point

Physical DescriptionLiquid

Physikochemische Eigenschaften

Schmelzpunkt: -35 °C · -35 °C
Siedepunkt: 159 °C · 159 °C
Dichte: 1.47 · 1.47
Brechungsindex: 1.481 · 1.4810-1.4850
storage temp.: Sealed in dry,Room Temperature
Aggregatzustand: clear liquid
Farbe: Colorless to Almost colorless
InChI: InChI=1S/C3H4Cl4/c4-2-1-3(5,6)7/h1-2H2
InChIKey: UTACNSITJSJFHA-UHFFFAOYSA-N
SMILES: C(Cl)(Cl)(Cl)CCCl
CAS Datenbank: 1070 · 1070-78-6(CAS DataBase Reference)
NIST chemische Informationen: 1 · Propane, 1,1,1,3-tetrachloro-(1070-78-6)
EPA chemische Informationen: 1 · Propane, 1,1,1,3-tetrachloro- (1070-78-6)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H226 (50%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, 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 4 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: Propane, 1,1,1,3-tetrachloro-

Propane, 1,1,1,3-tetrachloro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propane, 1,1,1,3-tetrachloro- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Hazard Classes and CategoriesFlam. Liq. 3 (50%)

Sicherheitsdaten

tsca: TSCA listed
ridadr: 1993
hs_code: 2903190090
RTECS-Nr.: TZ7000000
hazard_code: Xi
hazard_class: 3
packing_group: III

Chemie und Industrie

Verwendung und Herstellung

U.S. Production2023: 50,000,000 - <100,000,000 lb

Industry UsesIntermediate

General Manufacturing Information · 2 Einträge

All Other Basic Organic Chemical Manufacturing

Propane, 1,1,1,3-tetrachloro-: ACTIVE

Anwendungen · 1 Eintrag

Verwenden1,1,1,3-Tetrachloropropane (TCP) is a polychlorinated alkane compound that can be used to prepare a new generation of refrigerant hydrofluoroolefins (HFOs). For the gas-phase fluorination of TCP with hydrogen fluoride (HF), iron supported on hollow nano-MgF2 particles (Fe/MgF2) outperforms the chromium system as a catalyst and has the potential to replace the chromium system.