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Cyclohexenone
[CAS# 25512-62-3]

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Identification
Name Cyclohexenone
Synonyms 1-Cyclohex-2-Enone; Chebi:15977; Cyclohexen-3-One
Molecular Structure CAS#: 25512-62-3, Cyclohexenone
Molecular Formula C6H8O
Molecular Weight 96.13
CAS Registry Number 25512-62-3
SMILES O=C1CCCC=C1
InChI 1S/C6H8O/c7-6-4-2-1-3-5-6/h2,4H,1,3,5H2
InChIKey FWFSEYBSWVRWGL-UHFFFAOYSA-N
Properties
Density 20 (Expl.)
1.0±0.1g/cm3 (Cal.)
Melting point -53°C (Expl.)
Boiling point 167-169°C (Expl.)
166.6±10.0°C at 760 mmHg (Cal.)
Flash point 55.7±5.1°C (Cal.)
56°C (Expl.)
Refractive index 1.488 (Expl.)
Safety Data
Safety Code S9;S20;S23;S26;S27;S36/37/39;S45  Details
Risk Code R22;R23/24;R36  Details
Hazard Symbol symbol  T  Details
Transport Information UN2929
Safety Description DANGER: FLAMMABLE, POISON, severe irritant
DANGER: POISON, FLAMMABLE, causes CNS injury
References
(1) Marcin Kwit, Jacek Gawronski, Derek R. Boyd, Narain D. Sharma and Magdalena Kaik. Circular dichroism, optical rotation and absolute configuration of 2-cyclohexenone-cis-diol type phenol metabolites: redefining the role of substituents and 2-cyclohexenone conformation in electronic circular dichroism spectra, Org. Biomol. Chem., 2010, 8, 5635.
Market Analysis Reports
List of Reports Available for Cyclohexenone
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