ChemicalBook Product Catalog Chemical Reagents Organic reagents Cyanide / nitrile 4'-Octyl[1,1'-biphenyl]-4-carbonitrile

4'-Octyl[1,1'-biphenyl]-4-carbonitrile

Chemical Properties

Melting point	20-22℃
Boiling point	218°C/2mmHg(lit.)
Density	1.00±0.1 g/cm3(Predicted)
Flash point	>230 °F
storage temp.	Sealed in dry,Room Temperature
form	liquid crystal (nematic)
color	White or Colorless
Water Solubility	Insoluble in water.
λmax	276nm(EtOAc)(lit.)
InChI	InChI=1S/C21H25N/c1-2-3-4-5-6-7-8-18-9-13-20(14-10-18)21-15-11-19(17-22)12-16-21/h9-16H,2-8H2,1H3
InChIKey	CSQPODPWWMOTIY-UHFFFAOYSA-N
SMILES	C1(C2=CC=C(CCCCCCCC)C=C2)=CC=C(C#N)C=C1
CAS DataBase Reference	52709-84-9(CAS DataBase Reference)
NIST Chemistry Reference	[1,1'-Biphenyl]-4-carbonitrile, 4'-octyl-(52709-84-9)
EPA Substance Registry System	[1,1'-Biphenyl]-4-carbonitrile, 4'-octyl- (52709-84-9)

Hazard Codes	Xn
Risk Statements	20/21/22-36/37/38
Safety Statements	26-37/39
RIDADR	3276
WGK Germany	3
RTECS	DV1764400
TSCA	TSCA listed
HS Code	29269090
Storage Class	10 - Combustible liquids
Hazard Classifications	Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Eye Irrit. 2 Skin Irrit. 2 STOT SE 3