CAS 68065-81-6 trans-4'-(4-Amylcyclohexyl)biphenyl-4-carbonitrile

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trans-4'-(4-Amylcyclohexyl)biphenyl-4-carbonitrile

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Catalog Number

ACM68065816-1

Product Name

trans-4'-(4-Amylcyclohexyl)biphenyl-4-carbonitrile

Structure

CAS

68065-81-6

Category

Liquid Crystal (LC) Materials

Synonyms

trans-4'-(4-Pentylcyclohexyl)biphenyl-4-carbonitrile
trans-4-[4-(4-Amylcyclohexyl)phenyl]benzonitrile
trans-4-[4-(4-Pentylcyclohexyl)phenyl]benzonitrile
trans-4-Cyano-4'-(4-amylcyclohexyl)biphenyl
trans-4-Cyano-4'-(4-pentylcyclohexyl)biphenyl

IUPAC Name

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

Molecular Weight

331.50

Molecular Formula

C24H29N

Canonical SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

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

InChI Key

QKEBUASRTJNJJS-UHFFFAOYSA-N

Boiling Point

479.2 °C / 760 mmHg

Melting Point

96 °C

Purity

>98.0%(GC)

Appearance

White to Almost white powder to crystal

Storage

Sealed in dry. Room temperature.

Complexity

409

Covalently-Bonded Unit Count

EC Number

268-333-6

Exact Mass

331.23g/mol

Formal Charge

Hazard Statements

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

Heavy Atom Count

MDL Number

MFCD01076317

Monoisotopic Mass

331.23g/mol

Precautionary Statements

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.

Refractive Index

1.53

Rotatable Bond Count

Signal Word

Warning

Specific Gravity

1.03

XLogP3

8.2

MSDS

Download MSDS

COA