2-Bromethylphenylether

Benzene, (2-bromoethoxy)-

HCID 68526CAS 589-10-6

Grundinformationen

Standard-SMILES
BrCCOc1ccccc1
InChIKey
JJFOBACUIRKUPN-UHFFFAOYSA-N
Summenformel
C8H9BrO
Durchschnittliche Molmasse
201,06 g/mol
Monoisotopische Masse
199,98367701

Namen und Bezeichner

Bevorzugter Name
Benzene, (2-bromoethoxy)-
IUPAC
2-bromoethoxybenzene
Lokaler Name
2-Bromethylphenylether
Englischer Name
2-Phenoxyethylbromide
Summenformel
C8H9BrO
Molmasse
201.06

Namen und Synonyme

(2-Bromoethoxy)benzene589-10-62-Bromoethyl phenyl etherbeta-Bromophenetole2-Phenoxyethyl bromideBenzene, (2-bromoethoxy)-beta-Phenoxyethyl bromideNSC 8055Phenetole, beta-bromo-EINECS 209-634-4AI3-091751Bromo2phenoxyethane
Weitere Namen anzeigen
AKOS BC-2647-BromophenetoleBeta-broMoetherá-bromophenetoleB-BROMOPHENETOLEβ-BromophenetoleAKOS BBS-00006631
Phenetole, betabromo2phenoxyethyl bromide(2Bromoethoxy)benzenebetaPhenoxyethyl bromide2Bromoethyl phenyl etherBenzene, (2bromoethoxy)RefChem:562108Phenetole, betabromo (8CI)

Datenbank-Bezeichner

CAS
589-10-6
PubChem CID
68526
DTXSID
DTXSID9049322
ChEMBL
CHEMBL3188706
EC Number
209-634-4
Nikkaji
J94.983C

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,6
Polarare Oberfläche (TPSA)
9,2 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
3
Schwere Atome
10

Experimentelle und physikochemische Eigenschaften

Chemical ClassesOther Classes -> Halogenated Ethers
SpringerMaterials PropertiesDiamagnetic susceptibility
Physical DescriptionColorless crystalline solid; [Sigma-Aldrich MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
31 · 31-34 °C(lit.)
Siedepunkt
144 °C40 · 144 °C40 mm Hg(lit.)
Dichte
1.45 · 1.45
Brechungsindex
1.555 · 1.555-1.557
Flammpunkt
150 °F · 150 °F
storage temp.
Keep in dark place,Sealed in dry,Room Temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

This chemical does not meet GHS hazard criteria for 4.2% (2 of 48) of reports.

Warning

H302 (81.2%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory InformationStatus: Active Update: 23-09-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/16704
Hazards SummaryA skin and strong eye irritant; Harmful by ingestion; [Sigma-Aldrich MSDS]
Peroxide Forming Chemical · 3 Einträge

beta-Bromophenetole

D: Other compounds that may form peroxides

Kelly

Hazard Classes and CategoriesAcute Tox. 4 (81.2%)

Sicherheitsdaten

wgk
3
tsca
TSCA listed
ridadr
1325
hs_code
29093038
risk_code
36/37/38-22
hazard_code
Xi,Xn

Chemie und Industrie

Verwendung und Herstellung

General Manufacturing InformationBenzene, (2-bromoethoxy)-: ACTIVE

Anwendungen

Verwenden2-Phenoxyethyl bromide is used in the synthesis and antihypertensive activity of 4'-substituted spiro[4H-3,1-benzoxazine-4,4'-piperidin]-2(1H)-ones.

Darstellung · 1 Eintrag

synthetische2-Phenoxyethyl bromide is synthesized by the reaction of phenol and dibromoethane. Put phenol, dibromoethane and sodium hydroxide in a reaction pot and stir and mix, react at 110 °C for 6 hours, recover dibromoethane, the recovery amount is about 60%, wash with 5% sodium hydroxide solution and water, and divide Take the oil layer, distill under reduced pressure, and collect the fractions at 130-150°C (6.7kPa) to obtain (2-bromoethoxy)benzene.

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