4-hydroxycyclohex-2-en-1-one
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4-hydroxycyclohex-2-en-1-one
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CAS No:
30182-12-8
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Formula:
C6H8O2
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Chemical Name:
4-hydroxycyclohex-2-en-1-one
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Synonyms:
4-hydroxycyclohex-2-enone;4-Hydroxy-2-cyclohexen-1-one;2-Cyclohexen-1-one, 4-hydroxy-;4-hydroxycyclohex-2-en-1-one;ACMC-20mplt;4-hydroxycyclohex-2-enone;6-Hydroxycyclohexene-3-one;SCHEMBL3014862;SCHEMBL8613326;4-hydroxy-cyclohex-2-en-1-one;4-Hydroxy-2-cyclohexen-1-one #;30182-12-8;2-Cyclohexen-1-one, 4-hydroxy-, (S)-;121652-00-4
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CAS No:
Analysis Methods
| Name | Column Shape | Active Phase(℃) | Retention index | Temperature Control | Method | Comments | Reference |
|---|---|---|---|---|---|---|---|
| Normal alkane RI, polar column, temperature ramp | Capillary | DB-Wax | 2277. | temperature ramp | 60. m/0.25 mm/0.50 μm, Helium, 40. C @ 5. min, 2. K/min, 210. C @ 70. min | Moon, J.-K.Shibamoto, T.Formation of volatile chemicals from thermal degradation of less volatile cofee components: quinic acid, caffeic acid, and chlorogenic acidJ. Agric. Food Chem.2010, 58, 9, 5465-5470. |
Computed Properties
Molecular Weight:112.13
XLogP3:-0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Exact Mass:112.052429494
Monoisotopic Mass:112.052429494
Topological Polar Surface Area:37.3
Heavy Atom Count:8
Complexity:127
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
Guide of 4-hydroxycyclohex-2-en-1-one
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