4-Ethylcyclohexanone
Catalog Number
ACM5441510
CAS
5441-51-0
IUPAC Name
4-ethylcyclohexan-1-one
Molecular Weight
126.2
Molecular Formula
C8H14O
Product Information
Canonical SMILES
CCC1CCC(=O)CC1
Inchi
InChI=1S/C8H14O/c1-2-7-3-5-8(9)6-4-7/h7H,2-6H2,1H3
InChIKey
OKSDJGWHKXFVME-UHFFFAOYSA-N
Boiling Point
194 °C
Purity
>98.0%(GC)
Density
Air Sensitive
Appearance
Colorless to Almost colorless clear liquid
storage
Store under inert gas
Complexity
97.1
Hazard Statements
H227 : Combustible liquid.
Heavy Atom Count
9
MDL Number
MFCD00001644
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
1924964
Refractive Index
1.45
Rotatable Bond Count
1
Signal Word
Warning
Specific Gravity
0.92
Monoisotopic Mass
126.104465g/mol
Exact Mass
126.104465g/mol
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