CAS 96184-42-8 4-(trans-4-Vinylcyclohexyl)benzonitrile

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4-(trans-4-Vinylcyclohexyl)benzonitrile

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Catalog Number

ACM96184428-1

CAS Number

96184-42-8

Product Name

4-(trans-4-Vinylcyclohexyl)benzonitrile

Structure

Category

Liquid Crystal (LC) Building Blocks; Liquid Crystal (LC) Materials

Synonyms

1-Cyano-4-(trans-4-vinylcyclohexyl)benzene

IUPAC Name

4-(4-ethenylcyclohexyl)benzonitrile

Molecular Weight

211.31

Molecular Formula

C15H17N

Canonical SMILES

C=CC1CCC(CC1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H17N/c1-2-12-3-7-14(8-4-12)15-9-5-13(11-16)6-10-15/h2,5-6,9-10,12,14H,1,3-4,7-8H2

InChI Key

JHXJAWXZLWDDED-UHFFFAOYSA-N

Boiling Point

333.05 °C / 760 mmHg

Melting Point

58 °C

Purity

>98.0%(GC)

Appearance

White to Almost white powder to crystal

Storage

Inert atmosphere. Room temperature.

Complexity

269

Covalently-Bonded Unit Count

Exact Mass

211.1361g/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

MFCD11053490

Monoisotopic Mass

211.1361g/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.

Rotatable Bond Count

Signal Word

Warning

XLogP3

4.5

MSDS

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COA

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Spec Sheet

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