Triphenylpropylphosphoniumbromid

Propyltriphenylphosphonium bromide

HCID 80374CAS 1703757-22-5

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Grundinformationen

Standard-SMILES: CCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
InChIKey: XMQSELBBYSAURN-UHFFFAOYSA-M
Summenformel: C21H22BrP
Durchschnittliche Molmasse: 385,3 g/mol
Monoisotopische Masse: 384,06424943

Namen und Bezeichner

Bevorzugter Name: Propyltriphenylphosphonium bromide
IUPAC: triphenyl(propyl)phosphanium bromide
Lokaler Name: Triphenylpropylphosphoniumbromid
Englischer Name: Triphenyl(propyl)phosphonium bromide
Summenformel: C21H22BrP
Molmasse: 385.28

Namen und Synonyme

6228-47-3Propyltriphenylphosphonium bromiden-Propyltriphenylphosphonium bromideTriphenylpropylphosphonium bromide(1-Propyl)triphenylphosphonium bromidetriphenyl(propyl)phosphanium bromidetriphenyl(propyl)phosphanium;bromideMFCD00011843Phosphonium, triphenylpropyl-, bromideC21H22BrPtriphenyl propyl phosphonium bromideTriphenylpropylphosphonium Bromide; Bromo(propyl)triphenylphosphorane; NSC 50539; Propyltriphenylphosphonium Bromide;

Weitere Namen anzeigen

NSC 50539triphenyl(propTriphenylpropylphospPhosphonium,triphenylpropyl-PropyltriphenylphosphoniuM broPropyltriphenylphosphonium bromldeN-PROPYLTRIPHENYLPHOSPHONIUMCHLORIDE

EINECS 228-330-2n-propyl triphenylphosphonium bromidePropyltriphenylphosphonium(n-Propyl)triphenylphosphoniuMSCHEMBL164032propyl triphenylphosphine bromideCHEMBL3334701Propyltriphenlyphosphonium bromide

Datenbank-Bezeichner

CAS: 1703757-22-5、6228-47-3
PubChem CID: 80374
DTXSID: DTXSID80977847
ChEMBL: CHEMBL3334701
EC Number: 228-330-2

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 5
Schwere Atome: 23
Formalladung: 0
Komplexität: 260

Physikochemische Eigenschaften

Schmelzpunkt: 236 · 236-238 °C
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
Löslichkeit: DMSO (Sparingly, Heated), Methanol (Slightly)
Aggregatzustand: Solid
Farbe: White to Off-White
Wasserlöslichkeit: soluble
BRN: 3599726 · 3599726
Stabilität: Hygroscopic
InChI: InChI=1S/C21H22P.BrH/c1-2-18-22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;/h3-17H,2,18H2,1H3;1H/q+1;/p-1
InChIKey: XMQSELBBYSAURN-UHFFFAOYSA-M
SMILES: [P+](CCC)(C1C=CC=CC=1)(C1C=CC=CC=1)C1=CC=CC=C1.[Br-]
CAS Datenbank: 6228 · 6228-47-3(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

This chemical does not meet GHS hazard criteria for 2% (1 of 50) of reports.

Warning

H302 (86%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 50 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: 12-12-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/30276

Hazard Classes and CategoriesAcute Tox. 4 (86%)

Sicherheitsdaten

F: 3-8
wgk: 3
hs_code: 29319090
risk_code: 36/37/38-21/22
hazard_code: Xn
safety_code: 36/37-36/37/39-26
Speicherklasse: 11 - Combustible Solids
Hazard Classifications: Acute Tox. 4 Oral

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwendenn-Propyltriphenylphosphonium Bromide, is an analogue of phosphonium, acting as reversible inhibitors of cholinesterases of different animals. It has also been shown to be part of Phosphonium salts, having antiviral activity against influenza virus A.