CAS 79887-09-5 1-Butyl-4-ethynylbenzene - Materials / Alfa Chemistry

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1-Butyl-4-ethynylbenzene

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Catalog Number

ACM79887095

Product Name

1-Butyl-4-ethynylbenzene

Structure

CAS

79887-09-5

Category

Liquid Crystal (LC) Building Blocks

Synonyms

4-Butylphenylacetylene

IUPAC Name

1-butyl-4-ethynylbenzene

Molecular Weight

158.24

Molecular Formula

C12H14

Canonical SMILES

CCCCC1=CC=C(C=C1)C#C

InChI

InChI=1S/C12H14/c1-3-5-6-12-9-7-11(4-2)8-10-12/h2,7-10H,3,5-6H2,1H3

InChI Key

ZVWWYEHVIRMJIE-UHFFFAOYSA-N

Purity

>97.0%(GC)

Density

Air Sensitive,Heat Sensitive

Appearance

Colorless to Light orange to Yellow clear liquid

Storage

Store under inert gas,0-10°C

Complexity

152

Covalently-Bonded Unit Count

Exact Mass

158.10955g/mol

Formal Charge

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.H227 : Combustible liquid.

Heavy Atom Count

MDL Number

MFCD00173885

Monoisotopic Mass

158.10955g/mol

Precautionary Statements

P501 : Dispose of contents/ container to an approved waste disposal plant.P210 : Keep away from heat/sparks/open flames/hot surfaces. No smoking.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P370 + P378 : In case of fire: Use dry sand, dry chemical or alcohol-resistant foam to extinguish.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.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.P403 + P235 : Store in a well-ventilated place. Keep cool.

Refractive Index

1.53

Rotatable Bond Count

Signal Word

Warning

Specific Gravity

0.9

XLogP3

MSDS

Download MSDS

COA

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