Specification
Synonyms
1-(4-Ethylphenyl)-2-propanone
IUPAC Name
1-(4-Ethylphenyl)propan-2-one
Canonical SMILES
CCC1=CC=C(C=C1)CC(=O)C
InChI
InChI=1S/C11H14O/c1-3-10-4-6-11(7-5-10)8-9(2)12/h4-7H,3,8H2,1-2H3
InChI Key
DNAGWILBAXAZOH-UHFFFAOYSA-N
Boiling Point
241.0±9.0 °C
Monoisotopic Mass
162.104465066
Refractive Index
n20/D 1.5120(lit.)
Safety Description
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
Storage Conditions
Dry place,Room Temperature
Topological Polar Surface Area
17.1 Ų