2-(2-Ethylhexyl)thiophene
Catalog Number
ACM4891445
CAS
4891-44-5
IUPAC Name
2-(2-ethylhexyl)thiophene
Molecular Weight
196.35
Molecular Formula
C12H20S
Product Information
Canonical SMILES
CCCCC(CC)CC1=CC=CS1
InChI
InChI=1S/C12H20S/c1-3-5-7-11(4-2)10-12-8-6-9-13-12/h6,8-9,11H,3-5,7,10H2,1-2H3
InChI Key
JACCFQMSOHCQFN-UHFFFAOYSA-N
Purity
>98.0%(GC)
Density
Heat Sensitive
Appearance
Colorless to Light yellow to Light orange clear liquid
Storage
0-10°C
Complexity
122
Exact Mass
196.128572g/mol
Hazard Statements
H227 : Combustible liquid.
Heavy Atom Count
13
MDL Number
MFCD26743668
Monoisotopic Mass
196.128572g/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.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.P403 + P235 : Store in a well-ventilated place. Keep cool.
Reaxys Registry Number
21555727
Refractive Index
1.49
Rotatable Bond Count
6
Signal Word
Warning
Specific Gravity
0.93
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