1,3-Bis(2,6-diisopropylphenyl)-4,5-dihydro-1H-imidazol-3-ium tetrafluoroborate

HCID 11375006CAS 282109-83-5

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Grundinformationen

Standard-SMILES: CC(C)c1cccc(C(C)C)c1N1C=[N+](c2c(C(C)C)cccc2C(C)C)CC1.F[B-](F)(F)F
InChIKey: KFZBJQUHHALFSR-UHFFFAOYSA-N
Summenformel: C27H39BF4N2
Durchschnittliche Molmasse: 478,4 g/mol
Monoisotopische Masse: 478,31424253

Namen und Bezeichner

Bevorzugter Name: 1,3-Bis(2,6-diisopropylphenyl)-4,5-dihydro-1H-imidazol-3-ium tetrafluoroborate
IUPAC: 1,3-bis[2,6-di(propan-2-yl)phenyl]-4,5-dihydroimidazol-1-ium tetrafluoroborate
Englischer Name: 1,3-Bis(2,6-di-I-propylphenyl)-4,5-dihydroimidazolium tetrafluoroborate
Summenformel: C27H39BF4N2
Molmasse: 478.42

Namen und Synonyme

1,3-Bis(2,6-diisopropylphenyl)-4,5-dihydro-1H-imidazol-3-ium tetrafluoroborateRefChem:413931625-294-3282109-83-51,3-Bis(2,6-diisopropylphenyl)-4,5-dihydroimidazolium tetrafluoroborate1,3-Bis(2,6-di-i-propylphenyl)-4,5-dihydroimidazolium tetrafluoroborateMFCD03412153SIPr-HBF4SCHEMBL260939C27H39BF4N2DTXSID60463955DS-8710

Weitere Namen anzeigen

6-DI-I-PROPYLPHENYL)-4BisdiisopropylphenyldihydroimidazoliumtetrafluoroboraBisdiisopropylphenyldihydroimidazoliumtetrafluoroborate1,3-Bis(2,6-diisopropylphenyl)-4,5-dihydroiMidazoliuM tetraf1,3-BIS(2,6-DIISOPROPYLPHENYL) IMIDAZOLIDINIUM TETRAFLUOROBORATE, 97+%1,3-BIS(2,6-DI-ISOPROPYLPHENYL)-4,5-DIHYDROIMIDAZOLIUM TETRAFLUOROBORATEN,N′-bis(2,6-disopropylphenyl)dihydroimidazoletetrafluoroboronic acidsalt1,3-Bis(2,6-di-i-propylphenyl)-4,5-dihydroimidazoliumtetrafluoroborate,95%

MB02767BP-12269SY0098761,3-bis[2,6-di(propan-2-yl)phenyl]-4,5-dihydroimidazol-1-ium;tetrafluoroborate1,3-bis[2,6-di(propan-2-yl)phenyl]-4,5-dihydroimidazol-1-ium,tetrafluoroborate4,5-Dihydro-1,3-bis(2,6-diisopropylphenyl)imidazolium tetrafluoroborateA819375KFZBJQUHHALFSR-UHFFFAOYSA-N

Datenbank-Bezeichner

CAS: 282109-83-5
PubChem CID: 11375006
DTXSID: DTXSID60463955
EC Number: 625-294-3

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA): 6,3 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 6
Schwere Atome: 34
Formalladung: 0
Komplexität: 486

Physikochemische Eigenschaften

Schmelzpunkt: 300 · >300
storage temp.: Inert atmosphere,Room Temperature
Aggregatzustand: Powder
Farbe: White
InChI: InChI=1S/C27H39N2.BF4/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;2-1(3,4)5/h9-14,17-21H,15-16H2,1-8H3;/q+1;-1
InChIKey: KFZBJQUHHALFSR-UHFFFAOYSA-N
SMILES: C1(=C(C(C)C)C=CC=C1C(C)C)N1CC[N+](C2C(C(C)C)=CC=CC=2C(C)C)=C1.[B-](F)(F)(F)F

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H314 (97.5%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.