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1-Ethynyl-4-propylbenzene

Catalog Number
ACM62452737-1
CAS Number
62452-73-7
Product Name
1-Ethynyl-4-propylbenzene
Structure
Category
Liquid Crystal (LC) Building Blocks
Synonyms
4-Propylphenylacetylene
IUPAC Name
1-ethynyl-4-propylbenzene
Molecular Weight
144.22
Molecular Formula
C11H12
Canonical SMILES
CCCC1=CC=C(C=C1)C#C
InChI
InChI=1S/C11H12/c1-3-5-11-8-6-10(4-2)7-9-11/h2,6-9H,3,5H2,1H3
InChI Key
UVFFOABHOIMLNB-UHFFFAOYSA-N
Boiling Point
204.9 °C / 760 mmHg
Purity
>96.0%(GC)
Appearance
Light yellow to Brown clear liquid
Storage
Keep in dark place. Sealed in dry. Room temperature.
Complexity
141
Covalently-Bonded Unit Count
1
Exact Mass
144.0939g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.H227 : Combustible liquid.
Heavy Atom Count
11
MDL Number
MFCD00173886
Monoisotopic Mass
144.0939g/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
3
Signal Word
Warning
Specific Gravity
0.91
XLogP3
3.5
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