4-Chlor-3-(trifluormethyl)benzaldehyd

4-Chloro-3-(trifluoromethyl)benzaldehyde

HCID 118642CAS 34328-46-6

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Grundinformationen

Standard-SMILES: O=Cc1ccc(Cl)c(C(F)(F)F)c1
InChIKey: NIHMMULLFBKTOK-UHFFFAOYSA-N
Summenformel: C8H4ClF3O
Durchschnittliche Molmasse: 208,56 g/mol
Monoisotopische Masse: 207,99027709

Namen und Bezeichner

Bevorzugter Name: 4-Chloro-3-(trifluoromethyl)benzaldehyde
IUPAC: 4-chloro-3-(trifluoromethyl)benzaldehyde
Lokaler Name: 4-Chlor-3-(trifluormethyl)benzaldehyd
Englischer Name: 4-Chloro-3-(trifluoromethyl)benzaldehyde
Summenformel: C8H4ClF3O
Molmasse: 208.57

Namen und Synonyme

4-Chloro-3-(trifluoromethyl)benzaldehyde34328-46-6EINECS 251-940-5DTXSID50187895RefChem:98417DTXCID10110386251-940-5MFCD000407224-chloro-3-trifluoromethylbenzaldehyde4-chloro-3-trifluoromethyl-benzaldehydeSCHEMBL40676CL8344

Weitere Namen anzeigen

TIMTEC-BB SBB0034684-chloro-3-trifluorobenzaldehyde2-Chloro-5-formylbenzotrifluoride3-Trifluoromethyl-4-Chlorobenzaldehyde4-Chloro-3-(trifluoromethyl)benzaldehyde>4-Chloro-3-(trifluoromethyl)benzaldehyde98%4-Chloro-3-(trifluoromethyl)benzaldehyde 98%3-trifluoromethyl-4-chlorophenyl carbaldehyde

AKOS0052577853-trifluoromethyl-4-chloro-benzaldehydePS-8032AC-27962SY0206914-Chloro-3-(trifluoromethyl)benzaldehyde, 97%Z1065866152Benzaldehyde, 4-chloro-3-(trifluoromethyl)-

Datenbank-Bezeichner

CAS: 34328-46-6
PubChem CID: 118642
DTXSID: DTXSID50187895
EC Number: 251-940-5
Nikkaji: J287.902F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,6
Polarare Oberfläche (TPSA): 17,1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 1
Schwere Atome: 13
Formalladung: 0
Komplexität: 192

Physikochemische Eigenschaften

Siedepunkt: 218 °C · 218 °C(lit.)
Dichte: 1.45 g/mL · 1.45 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.504(lit.)
Flammpunkt: 227 °F · 227 °F
storage temp.: Keep in dark place,Sealed in dry,Room Temperature
Aggregatzustand: Liquid
Farbe: Clear colorless
BRN: 2101897 · 2101897
InChI: 1S/C8H4ClF3O/c9-7-2-1-5(4-13)3-6(7)8(10,11)12/h1-4H
InChIKey: NIHMMULLFBKTOK-UHFFFAOYSA-N
SMILES: FC(F)(F)c1cc(C=O)ccc1Cl
CAS Datenbank: 34328 · 34328-46-6(CAS DataBase Reference)

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 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

wgk: 3
hs_code: 29130000
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-36
hazard_class: IRRITANT
Speicherklasse: 10 - Combustible liquids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Anwendungen

Verwenden4-Chloro-3-(trifluoromethyl)benzaldehyde is an important raw material and intermediate used in organic synthesis, pharmaceuticals agrochemicals and dyestuff fields.