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2,4-Dichlor-1-(trichlormethyl)benzol

2,4-Dichlorophenyltrichloromethane

HCID 25607
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Grundinformationen

CAS
13014-18-1
Standard-SMILES
Clc1ccc(C(Cl)(Cl)Cl)c(Cl)c1
InChIKey
KZSNBJMYJWDVTK-UHFFFAOYSA-N
Summenformel
C7H3Cl5
Durchschnittliche Molmasse
264,4 g/mol
Monoisotopische Masse
261,8677385

Überblick

2,4,alpha,alpha,alpha-pentachlorotoluene is a white crystalline powder. (NTP, 1992)

Namen und Bezeichner

Bevorzugter Name
2,4-Dichlorophenyltrichloromethane
IUPAC
2,4-dichloro-1-(trichloromethyl)benzene
Lokaler Name
2,4-Dichlor-1-(trichlormethyl)benzol
Englischer Name
2,4-Dichlorobenzotrichloride
Summenformel
C7H3Cl5
Molmasse
264.36

Namen und Synonyme

13014-18-12,4-Dichloro-1-(trichloromethyl)benzene2,4-DichlorobenzotrichlorideBenzene, 2,4-dichloro-1-(trichloromethyl)-2,4-Dichlorophenyltrichloromethane1,3-Dichloro-4-(trichloromethyl)benzene2,4,alpha,alpha,alpha-Pentachlorotoluenealpha,alpha,alpha,2,4-PentachlorotolueneCCRIS 6087DTXSID3025839EINECS 235-868-13JE22G4JRY
Weitere Namen anzeigen
dichlorobenzotrichloride2,4-DCTCα,α,α,2,4-Pentachlorotoluene2,4-Dichlorobenzotrichloride >2,4-DICHLOROBENZOTRICHLORIDE 99+%2,4-Dichlor-1-(trichlormethyl)benzol2,4-dichloro-1-(trichloromethyl)-benzen
Toluene, alpha,alpha,alpha,2,4-pentachloro-NSC 403840BRN 0514239AI3-02376Toluene, .alpha.,.alpha.,.alpha.,2,4-pentachloro-NSC-403840DTXCID605839EC 235-868-1

Datenbank-Bezeichner

CAS

Eigenschaften

Berechnete Struktureigenschaften

XLogP
5,5
Polarare Oberfläche (TPSA)
0 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
0
Frei drehbare Bindungen
0
Schwere Atome
12
Formalladung
0
Komplexität
152

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Solubilityless than 1 mg/mL at 72 °F (NTP, 1992)
Melting Point115 to 120 °F (NTP, 1992)
Physical Description2,4,alpha,alpha,alpha-pentachlorotoluene is a white crystalline powder. (NTP, 1992)

Physikochemische Eigenschaften

Schmelzpunkt
49 °C · 49°C
Siedepunkt
288 °C · 288°C
Dichte
1.5935 · 1.5935 (estimate)
Dampfdruck
0.2 · 0.2-4.3Pa at 20-50℃
Brechungsindex
1.5939 · 1.5939 (estimate)
Flammpunkt
112 ℃ · >112℃
storage temp.
2 · 2-8°C
Löslichkeit
Chloroform (Sparingly), Methanol (Slightly)

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P273, P280, P305+P351+P338, P337+P317, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 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: Benzene, 2,4-dichloro-1-(trichloromethyl)-

Status: Active Update: 19-09-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/5716

DOT LabelCorrosive
Fire HazardsFlash point data for this chemical are not available. It is probably combustible. (NTP, 1992)
Health HazardsSYMPTOMS: Symptoms of exposure to this compound may include skin and eye irritation.
Reactive GroupHalogenated Organic Compounds
Reactivity Profile · 1 Eintrag

Simple aromatic halogenated organic compounds, such as 2,4,ALPHA,ALPHA,ALPHA-PENTACHLOROTOLUENE, are very unreactive. Halogenated organics generally become less reactive as more of their hydrogen atoms are replaced with halogen atoms. Materials in this group may be incompatible with strong oxidizing and reducing agents. Also, they may be incompatible with many amines, nitrides, azo/diazo compounds, alkali metals, and epoxides.

Air and Water ReactionsThis chemical may be sensitive to exposure to moisture. Insoluble in water.

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationBenzene, 2,4-dichloro-1-(trichloromethyl)-: INACTIVE

Anwendungen

Verwenden2,4-Dichlorobenzotrichloride is used in the synthesis of aromatic acid chlorides.

Anbieter70 Anbieter

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Auf dieser SeiteGrundinformationenÜberblickNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
13014-18-1
PubChem CID
25607
DTXSID
DTXSID3025839
ChEMBL
CHEMBL1560541
UNII
3JE22G4JRY
EC Number
235-868-1
Nikkaji
J140.754F
Aggregatzustand
Solid
Farbe
White to Off-White
LogP
5.18 at · 5.18 at 25℃
CAS Datenbank
13014 · 13014-18-1(CAS DataBase Reference)
EPA chemische Informationen
2 · 2,4-Dichlorobenzotrichloride (13014-18-1)
Hazard Classes and CategoriesEye Irrit. 2 (100%)

Sicherheit und Schutzausrüstung

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1 Eintrag

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1 Eintrag

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then you should dampen the solid spill material with 60-70% ethanol and transfer the dampened material to a suitable container. Use absorbent paper dampened with 60-70% ethanol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Isolation and EvacuationExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Personal Protective Equipment (PPE) · 1 Eintrag

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

Sicherheitsdaten

tsca
TSCA listed
ridadr
3261
hs_code
2903998090
RTECS-Nr.
CZ5475020
risk_code
34
Toxizität
mmo-sat 333 mg/plate EMMUEG 19(Suppl 21),2,92
safety_code
26-36/37/39
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