4'-(Decyloxy)[1,1'-biphenyl]-4-carbonitril

[1,1'-Biphenyl]-4-carbonitrile, 4'-(decyloxy)-

HCID 112405CAS 70247-25-5

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Grundinformationen

Standard-SMILES: CCCCCCCCCCOc1ccc(-c2ccc(C#N)cc2)cc1
InChIKey: VCYXELFOIWRYLA-UHFFFAOYSA-N
Summenformel: C23H29NO
Durchschnittliche Molmasse: 335,5 g/mol
Monoisotopische Masse: 335,22491455

Namen und Bezeichner

Bevorzugter Name: [1,1'-Biphenyl]-4-carbonitrile, 4'-(decyloxy)-
IUPAC: 4-(4-decoxyphenyl)benzonitrile
Lokaler Name: 4'-(Decyloxy)[1,1'-biphenyl]-4-carbonitril
Englischer Name: 4'-(decyloxy)[1,1'-biphenyl]-4-carbonitrile
Summenformel: C23H29NO
Molmasse: 335.48

Namen und Synonyme

70247-25-54-Cyano-4'-decyloxybiphenylEINECS 274-495-94'-(decyloxy)[1,1'-biphenyl]-4-carbonitrile[1,1'-Biphenyl]-4-carbonitrile, 4'-(decyloxy)-DTXSID6072057(1,1'-Biphenyl)-4-carbonitrile, 4'-(decyloxy)-4'-(Decyloxy)(1,1'-biphenyl)-4-carbonitrileRefChem:391096DTXCID8046662274-495-94'-(DECYLOXY)-[1,1'-BIPHENYL]-4-CARBONITRILE

Weitere Namen anzeigen

4-n-decyloxy-4'-cyanobiphenyl4'-Decyloxybiphenyl-4-carbonitrile4-[4-(Decyloxy)phenyl]benzonitrile

4'-Cyano-4-decyloxybiphenyl4-(4-decoxyphenyl)benzonitrile10OCB(1,1-Biphenyl)-4-carbonitrile, 4-(decyloxy)-MFCD012180344'-Decyloxy-4-biphenylcarbonitrile4-(4-decyloxyphenyl)benzenecarbonitrile4-decyloxy-4'-cyanobiphenyl

Datenbank-Bezeichner

CAS: 70247-25-5
PubChem CID: 112405
DTXSID: DTXSID6072057
EC Number: 274-495-9
Nikkaji: J288.900E

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 7,9
Polarare Oberfläche (TPSA): 33 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 11
Schwere Atome: 25
Formalladung: 0
Komplexität: 369

Experimentelle und physikochemische Eigenschaften

Chemical ClassesLiquid Crystal (LCM) Monomers

SpringerMaterials PropertiesChemical diffusion

Physikochemische Eigenschaften

Siedepunkt: 479.6 · 479.6±38.0 °C(Predicted)
Dichte: 1.02 · 1.02±0.1 g/cm3(Predicted)
storage temp.: Store at room temperature
Löslichkeit: soluble in Acetone
Aggregatzustand: powder to crystal
Farbe: White to Almost white
EPA chemische Informationen: 1 · [1,1'-Biphenyl]-4-carbonitrile, 4'-(decyloxy)- (70247-25-5)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302+H312+H332 (100%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

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

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.