Bromtriphenylethylen

1-Bromo-1,2,2-triphenylethene

HCID 15354

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Grundinformationen

CAS: 1607-57-4
Standard-SMILES: BrC(=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIKey: VUQVJIUBUPPCDB-UHFFFAOYSA-N
Summenformel: C20H15Br
Durchschnittliche Molmasse: 335,2 g/mol
Monoisotopische Masse: 334,03571

Namen und Bezeichner

Bevorzugter Name: 1-Bromo-1,2,2-triphenylethene
IUPAC: (1-bromo-2,2-diphenylethenyl)benzene
Lokaler Name: Bromtriphenylethylen
Englischer Name: Bromotriphenylethylene
Summenformel: C20H15Br
Molmasse: 335.24

Namen und Synonyme

Bromotriphenylethylene1607-57-4Triphenylethylene bromidePhenylstilbene bromideBenzene, 1,1',1''-(1-bromo-1-ethenyl-2-ylidene)tris-MRW5MKO6LZ1-Bromo-1,2,2-triphenylethene1-bromo-1,2,2-triphenylethyleneNSC-38797DTXSID80166971RefChem:861826DTXCID2089462

Weitere Namen anzeigen

AURORA KA-6594JACS-1607-57-4BromotriphenyletheneBromtriphenylethylen

216-531-82-Bromo-1,1,2-triphenylethylene(2-Bromoethene-1,1,2-triyl)tribenzeneEitriphin(1-bromo-2,2-diphenylethenyl)benzeneETHYLENE, BROMOTRIPHENYL-Triphenylvinyl bromideMFCD00000135

Datenbank-Bezeichner

CAS: 1607-57-4
PubChem CID: 15354
DTXSID: DTXSID80166971
UNII: MRW5MKO6LZ
EC Number: 216-531-8
Nikkaji: J78.036G

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 6,6
Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 0
Frei drehbare Bindungen: 3
Schwere Atome: 21
Formalladung: 0
Komplexität: 319

Experimentelle und physikochemische Eigenschaften

Physical DescriptionPale yellow powder; [Alfa Aesar MSDS]

Physikochemische Eigenschaften

Schmelzpunkt: 115 · 115-117 °C(lit.)
Siedepunkt: 391.41 °C · 391.41°C (rough estimate)
Dichte: 1.3419 · 1.3419 (rough estimate)
Brechungsindex: 1.6 · 1.6000 (estimate)
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Aggregatzustand: powder to crystal
Farbe: Light orange to Yellow to Green
BRN: 2052962 · 2052962
CAS Datenbank: 1607 · 1607-57-4(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H361 (80%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]；H361f (20%): Suspected of damaging fertility [Warning Reproductive toxicity]

P203, P280, P318, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；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.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: Benzene, 1,1',1''-(1-bromo-1-ethenyl-2-ylidene)tris-

Benzene, 1,1',1''-(1-bromo-1-ethenyl-2-ylidene)tris-: Does not have an individual approval but may be used under an appropriate group standard

Hazards SummaryMay cause irritation; Suspected of being toxic to fertility or the developing child; [Alfa Aesar MSDS] See 1,2-Diphenylethylene, cis-1,2-Diphenylethylene, and trans-1,2-Diphenylethylene.