The (1,1'-Biphenyl)-4-carbonitrile, 4'-octyl- with CAS registry number of 52709-84-9 is also known as 4-Cyano-4'-octylbiphenyl. The IUPAC name is 4-(4-Octylphenyl)benzonitrile. It belongs to product categories of Biphenyl & Diphenyl ether; Liquid Crystals; Nematic; Organic Electronics and Photonics. Its EINECS registry number is 258-120-6. In addition, the formula is C₂₁H₂₅N and the molecular weight is 291.43. This chemical is a liquid crystal and should be stored in sealed containers in cool, dry place and away from oxidizing agents.

Physical properties about (1,1'-Biphenyl)-4-carbonitrile, 4'-octyl- are: (1)ACD/LogP: 7.47; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.47; (4)ACD/LogD (pH 7.4): 7.47; (5)ACD/BCF (pH 5.5): 281941.22; (6)ACD/BCF (pH 7.4): 281941.22; (7)ACD/KOC (pH 5.5): 277202.84; (8)ACD/KOC (pH 7.4): 277202.84; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Index of Refraction: 1.554; (13)Molar Refractivity: 93.06 cm³; (14)Molar Volume: 290.2 cm³; (15)Surface Tension: 43.1 dyne/cm; (16)Density: 1 g/cm³; (17)Flash Point: 217.7 °C; (18)Enthalpy of Vaporization: 69 kJ/mol; (19)Boiling Point: 433.9 °C at 760 mmHg; (20)Vapour Pressure: 9.86E-08 mmHg at 25 °C.

Uses of (1,1'-Biphenyl)-4-carbonitrile, 4'-octyl-: it is used to produce 4'-octyl-biphenyl-4-carbonitrile. The reaction occurs with reagent acetic anhydride and other condition of heating for 2 hours. The yield is about 83%.

When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. Besides, it is harmful by inhalation, in contact with skin and if swallowed. During using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
2. 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
3. InChIKey: CSQPODPWWMOTIY-UHFFFAOYSA-N

The toxicity data is as follows: