2-(4-Chlorphenoxy)ethanol

2-(4-Chlorophenoxy)ethanol

HCID 15907CAS 1892-43-9

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Grundinformationen

Standard-SMILES: OCCOc1ccc(Cl)cc1
InChIKey: GEGSSUSEWOHAFE-UHFFFAOYSA-N
Summenformel: C8H9ClO2
Durchschnittliche Molmasse: 172,61 g/mol
Monoisotopische Masse: 172,02910721

Überblick

2-(4-chlorphenoxy)-ethanol is an aromatic ether.

Namen und Bezeichner

Bevorzugter Name: 2-(4-Chlorophenoxy)ethanol
IUPAC: 2-(4-chlorophenoxy)ethanol
Lokaler Name: 2-(4-Chlorphenoxy)ethanol
Englischer Name: 2-(4-Chlorophenoxy)ethanol
Summenformel: C8H9ClO2
Molmasse: 172.61

Namen und Synonyme

2-(4-Chlorophenoxy)ethanolChlorophetanolEthanol, 2-(4-chlorophenoxy)-2-(4-chlorophenoxy)ethan-1-ol2-(4-chlorphenoxy)-ethanolp-Chlorfenylmonoglykolether2-(4'-Chlorfenoxy)ethanolp-Chlorophenyl 2-hydroxyethyl etherNSC 8133p-Chlorfenylmonoglykolether [Czech]chlorophenoxyethanolEINECS 217-578-7

Weitere Namen anzeigen

FungisanMycotetracidChloro-p-phenoxetol4-CHLOROPHENOXYETHANOL2-(4’-chlorfenoxy)ethanol2-(4-chlorophenoxy)-ethano2-(p-chlorophenoxy)-ethano2-(P-CHLOROPHENOXY)ETHANOL

2-(4'-Chlorfenoxy)ethanol [Czech]UNII-Q73I5T98DABRN 1365684AI3-022254-(2-Hydroxyethoxy)chlorobenzene2-(4'-Chlorophenoxy)ethanolEthylene glycol mono(p-chlorophenyl) etherDTXSID1062047

Datenbank-Bezeichner

CAS: 1892-43-9、38797-58-9
PubChem CID: 15907
DTXSID: DTXSID1062047
ChEMBL: CHEMBL3707367
ChEBI: CHEBI:135944
UNII: Q73I5T98DA
EC Number: 217-578-7
Nikkaji: J54.935E

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,8
Polarare Oberfläche (TPSA): 29,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 3
Schwere Atome: 11
Formalladung: 0
Komplexität: 100

Experimentelle und physikochemische Eigenschaften

DrugsPharmaceuticals -> Listed in ZINC15

SpringerMaterials PropertiesBoiling point

Physikochemische Eigenschaften

Schmelzpunkt: 30 °C · 30°C
Siedepunkt: 135 · 135-136°C 6mm
Dichte: 1.26 · 1.26
Brechungsindex: 1.551 · 1.5510
Flammpunkt: 135 · 135-136°C/6mm
storage temp.: 2 · 2-8°C
Aggregatzustand: powder to lump to clear liquid
pka: 14.18 · 14.18±0.10(Predicted)
Farbe: White or Colorless to Yellow
Wasserlöslichkeit: 3.1 g/L · Soluble in water 3.1 g/L @ 25°C.
BRN: 1365684 · 1365684
CAS Datenbank: 1892 · 1892-43-9(CAS DataBase Reference)
EPA chemische Informationen: 2 · Ethanol, 2-(4-chlorophenoxy)- (1892-43-9)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H302 (88.6%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Poly(oxy-1,2-ethanediyl), .alpha.-(4-chlorophenyl)-.omega.-hydroxy-

Chemical: Ethanol, 2-(4-chlorophenoxy)-

FRI - indicates a polymeric substance containing no free-radical initiator in its Inventory name but is considered to cover the designated polymer made with any free-radical initiator regardless of the amount used.

Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Hazard Classes and CategoriesAcute Tox. 4 (88.6%)

Sicherheitsdaten

tsca: TSCA listed
ridadr: 2811
hs_code: 2909.49.1500
RTECS-Nr.: KK2100000
risk_code: 21/22-36/38
Toxizität: rabbit,LD50,skin,500uL/kg (0.5mL/kg),American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
safety_code: 23-36/37/39
hazard_class: 6.1
packing_group: III