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1-Phenylpropan-2-One
[CAS# 136675-26-8]

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Identification
Name 1-Phenylpropan-2-One
Synonyms 1-Phenylacetone; Nsc 9827
Molecular Structure CAS#: 136675-26-8, 1-Phenylpropan-2-One
Molecular Formula C9H10O
Molecular Weight 134.18
CAS Registry Number 136675-26-8
EINECS 203-144-4
SMILES C1=C(CC(C)=O)C=CC=C1
InChI 1S/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
InChIKey QCCDLTOVEPVEJK-UHFFFAOYSA-N
Properties
Density 1.0±0.1g/cm3 (Cal.)
Boiling point 213.999°C at 760 mmHg (Cal.)
Flash point 87.5±7.3°C (Cal.)
References
(1) Cristina Rodríguez, Gonzalo de Gonzalo, Marco W. Fraaije and Vicente Gotor. Ionic liquids for enhancing the enantioselectivity of isolated BVMO-catalysed oxidations, Green Chem., 2010, 12, 2255.
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