Ethanol, 2-((2,6-dichlorophenyl)methoxy)-

HCID 13341669

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Grundinformationen

CAS: 85309-91-7
Standard-SMILES: OCCOCc1c(Cl)cccc1Cl
InChIKey: MCVIDUDFKDIJMZ-UHFFFAOYSA-N
Summenformel: C9H10Cl2O2
Durchschnittliche Molmasse: 221,08 g/mol
Monoisotopische Masse: 220,0057849

Namen und Bezeichner

Bevorzugter Name: Ethanol, 2-((2,6-dichlorophenyl)methoxy)-
IUPAC: 2-[(2,6-dichlorophenyl)methoxy]ethanol
Englischer Name: Ethanol, 2-[(2,6-dichlorophenyl)Methoxy]-
Summenformel: C9H10Cl2O2
Molmasse: 221.08

Namen und Synonyme

2-((2,6-Dichlorobenzyl)oxy)ethanolEthanol, 2-[(2,6-dichlorophenyl)methoxy]-2-[(2,6-dichlorobenzyl)oxy]ethanolEthanol, 2-((2,6-dichlorophenyl)methoxy)-RefChem:592107691-997-785309-91-72-(2,6-dichlorobenzyloxy)ethanol2-[(2,6-DICHLOROPHENYL)METHOXY]ETHANOLMFCD21337361SCHEMBL925766MCVIDUDFKDIJMZ-UHFFFAOYSA-N

Weitere Namen anzeigen

BNKY020-VT05Vilanterol Impurity 22Vilanterol Impurity 52*Nifuratel Impurity 27 (Furan)(2, 6-Dichlorobenzyl) Oxy]Ethanol2-[(2,6-Dichlorobenzyl)oxy]ethane2-[(2,6-Dichlorophenyl)methoxy]-ethanol

DTXSID5012963402-(2,6-dichlorobenzyloxyl)ethanolCS-M25902-(2,6-Dichlorobenzyloxy) ethanolAKOS0273397192-((2,6-dichlorobenzyl)oxy)ethan-1-olCS-13189DA-02260

Datenbank-Bezeichner

CAS: 85309-91-7
PubChem CID: 13341669
DTXSID: DTXSID501296340
EC Number: 691-997-7

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,1
Polarare Oberfläche (TPSA): 29,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 4
Schwere Atome: 13
Formalladung: 0
Komplexität: 134

Physikochemische Eigenschaften

Siedepunkt: 318.8 · 318.8±32.0 °C(Predicted)
Dichte: 1.327 · 1.327±0.06 g/cm3(Predicted)
storage temp.: Store at room temperature
pka: 14.3 · 14.30±0.10(Predicted)
InChI: InChI=1S/C9H10Cl2O2/c10-8-2-1-3-9(11)7(8)6-13-5-4-12/h1-3,12H,4-6H2
InChIKey: MCVIDUDFKDIJMZ-UHFFFAOYSA-N
SMILES: C(O)COCC1=C(Cl)C=CC=C1Cl

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 100% (11 of 11) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 11 of 11 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 11 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 11 of 11 reports by companies.；There are 0 notifications provided by 0 of 11 reports by companies with hazard statement code(s).；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.