trans-4'-(4-Pentylcyclohexyl)-4-biphenylcarbonitrile

Catalog Number

68065-81-6

CAS

68065-81-6

IUPAC Name

4-[4-(4-pentylcyclohexyl)phenyl]benzonitrile

Synonyms

1'-Biphenyl)-4-carbonitrile,4'-(4-pentylcyclohexyl)-,trans-(1; 4'-(4-pentylcyclohexyl)-1'-biphenyl]-4-carbonitriltrans-[; 4'-(4-pentyl-cyclohexyl)-biphenyl-4-carbonitrile; BCH5; trans-4-(4-Pentylcyclohexyl)-4'-cyanobiphenyl; ZLI-1131; TRANS-4-CYANO-4'-(4-N-PEN

Molecular Weight

331.49

Molecular Formula

C24H29N

Product Information

Purity

>98% by GC

MDL

MFCD01076317

Physical State

Solid

Appearance

White Powder

Storage

Sealed in dry. Room temperature.

Boiling Point

479.2±34.0 °C at 760 mmHg

Melting Point

95-97°C

Density

1.0±0.1 g/cm3

Refractive Index

1.53

Safety Information

Signal Word

Warning

Precautionary Statement

P501 : Dispose of contents/ container to an approved waste disposal plant.P261 : Avoid breathing dust/ fume/ gas/ mist/ vapors/ spray.P270 : Do not eat, drink or smoke when using this product.P271 : Use only outdoors or in a well-ventilated area.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ protective clothing/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.P301 + P312 + P330 : IF SWALLOWED: Call a POISON CENTER/doctor if you feel unwell. Rinse mouth.P302 + P352 + P312 : IF ON SKIN: Wash with plenty of water.Call a POISON CENTER/doctor if you feel unwell.P304 + P340 + P312 : IF INHALED: Remove person to fresh air and keep comfortable for breathing. Call a POISON CENTER/doctor if you feel unwell.

Hazard Statements

H302 + H312 + H332 : Harmful if swallowed, in contact with skin or if inhaled.H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Canonical SMILES

N#CC1=CC=C(C2=CC=C([C@H]3CC[C@H](CCCCC)CC3)C=C2)C=C1

InChI

InChI=1S/C24H29N/c1-2-3-4-5-19-6-10-21(11-7-19)23-14-16-24(17-15-23)22-12-8-20(18-25)9-13-22/h8-9,12-17,19,21H,2-7,10-11H2,1H3/t19-,21-

InChI Key

QKEBUASRTJNJJS-XUTJKUGGSA-N