Pentachlorocyclopropane

HCID 22631CAS 6262-51-7

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Grundinformationen

Standard-SMILES: ClC1C(Cl)(Cl)C1(Cl)Cl
InChIKey: IACJMSLMMMSESC-UHFFFAOYSA-N
Summenformel: C3HCl5
Durchschnittliche Molmasse: 214,3 g/mol
Monoisotopische Masse: 211,85208843

Namen und Bezeichner

Bevorzugter Name: Pentachlorocyclopropane
IUPAC: 1,1,2,2,3-pentachlorocyclopropane
Englischer Name: Pentachlorocyclopropane
Summenformel: C3HCl5
Molmasse: 214.3

Namen und Synonyme

PENTACHLOROCYCLOPROPANE1,1,2,2,3-PentachlorocyclopropaneCyclopropane, pentachloroRefChem:859692613-064-56262-51-7Cyclopropane, pentachloro-MFCD000107961,1,2,2,3-pentachloro-cyclopropaneNSC 139996BRN 1903418NSC-139996

Weitere Namen anzeigen

Pentachlorocyclopropane, GC 98%Pentachlorocyclopropane, GC 95+%PENTACHLOROCYCLOPROPANE, TECH., 90%Cyclopropane, 1,1,2,2,3-pentachloro-PENTACHLOROCYCLOPROPANE ISO 9001：2015 REACH

1,2,2,3,3-PentachlorocyclopropaneNSC139996pentachloro-cyclopropanC3HCl5V4TJ9AL9RFPentachlorocyclopropane,98%SCHEMBL777731SCHEMBL777732

Datenbank-Bezeichner

CAS: 6262-51-7
PubChem CID: 22631
DTXSID: DTXSID6073366
UNII: V4TJ9AL9RF
EC Number: 613-064-5
Nikkaji: J125.039F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3
Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 0
Frei drehbare Bindungen: 0
Schwere Atome: 8
Formalladung: 0
Komplexität: 103

Experimentelle und physikochemische Eigenschaften

Chemical ClassesOther Classes -> Halogenated Cyclic Hydrocarbons

SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy

Physical DescriptionColorless liquid; [Sigma-Aldrich MSDS]

Physikochemische Eigenschaften

Siedepunkt: 55 · 55-56 °C/7 mmHg (lit.)
Dichte: 1.668 g/mL · 1.668 g/mL at 25 °C (lit.)
Brechungsindex: 20 · n20/D 1.5169(lit.)
Flammpunkt: 213 °F · 213 °F
storage temp.: Sealed in dry,Room Temperature
Farbe: Colorless liquid
InChI: InChI=1S/C3HCl5/c4-1-2(5,6)3(1,7)8/h1H
InChIKey: IACJMSLMMMSESC-UHFFFAOYSA-N
SMILES: C1(Cl)(Cl)C(Cl)C1(Cl)Cl
EPA chemische Informationen: Cyclopropane, pentachloro- (6262-51-7)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazards Summary · 1 Eintrag

Causes tremor and necrotic gastrointestinal changes in dermal lethal-dose studies of rats; Causes visual field changes, somnolence, and convulsions in oral lethal-dose studies of rats; [RTECS] A skin and strong eye irritant; [Sigma-Aldrich MSDS] See Cyclopropane. See Octafluorocyclobutane.

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

wgk: 3
RTECS-Nr.: GZ2214500
risk_code: 36/37/38
Toxizität: LDLo orl-rat: 78 mg/kg EPASR* 8EHQ-0587-0678
hazard_code: Xi
safety_code: 26-37/39
Speicherklasse: 10 - Combustible liquids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Anwendungen

VerwendenPentachlorocyclopropane has been used in the preparation of:tetrachlorocyclopropene via reaction with 18M aqueous KOH at 80-85°Csubstituted phenyltrichlorocyclopropene derivatives