| Identification | More | [Name]
Ethyl 4-oxocyclohexanecarboxylate | [CAS]
17159-79-4 | [Synonyms]
4-CYCLOHEXANONECARBOXYLIC ACID ETHYL ESTER
4-(ETHOXYCARBONYL)CYCLOHEXANONE
4-OXO-CYCLOHEXANECARBOXYLIC ACID ETHYL ESTER
CYCLOHEXANONE-4-CARBOXYLIC ACID ETHYL ESTER
ETHYL 4-CYCLOHEXANONECARBOXYLATE
ETHYL 4-OXOCYCLOHEXANECARBOXYLATE
ETHYL CYCLOHEXANONE-4-CARBOXYLATE
ethyl 4-oxocyclohexancarboxylate
CyclohexanonecarboxylicAcidEthylEster,4-
Cyclohexanecarboxylic acid, 4-oxo-, ethyl ester
4-CYCLOHEXANONECARBOXYLIC ACID ETHYL ESTER 98+%
4-(Ethoxycarbonyl)cyclohexanone, Ethyl cyclohexanone-4-carboxylate
E2KH
Ethyloxocyclohexanecarboxylate | [EINECS(EC#)]
1806241-263-5 | [Molecular Formula]
C9H14O3 | [MDL Number]
MFCD00013285 | [Molecular Weight]
170.21 | [MOL File]
17159-79-4.mol |
| Chemical Properties | Back Directory | [Appearance]
clear colorless to yellow liquid | [Melting point ]
221-226 °C | [Boiling point ]
150-152 °C/40 mmHg (lit.) | [density ]
1.068 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.461(lit.)
| [Fp ]
>230 °F
| [storage temp. ]
Sealed in dry,Room Temperature | [solubility ]
Chloroform, Methanol | [form ]
Liquid | [color ]
Clear colorless to yellow | [Specific Gravity]
1.07 | [Water Solubility ]
insoluble | [BRN ]
2520501 | [InChIKey]
ZXYAWONOWHSQRU-UHFFFAOYSA-N | [CAS DataBase Reference]
17159-79-4(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection . | [WGK Germany ]
3
| [Hazard Note ]
Harmful/Irritant | [HazardClass ]
IRRITANT | [HS Code ]
29183000 |
| Hazard Information | Back Directory | [Chemical Properties]
clear colorless to yellow liquid | [Uses]
Employed in the preparation of dopamine agonists1 and the skeleton of tetracyclic diterpenes.2 | [Uses]
Ethyl 4-oxocyclohexanecarboxylate is a cyclohexanone derivative used in the study of cyclohexanone monooxygenase and its mutants as catalysts.It is also employed in the preparation of dopamine agonists1 and the skeleton of tetracyclic diterpenes.
| [Definition]
ChEBI: Ethyl 4-oxocyclohexanecarboxylate is an ethyl ester resulting from the formal condensation of the carboxy group of 4-oxocyclohexanecarboxylic acid with ethanol. It is an ethyl ester, a cyclohexanecarboxylate ester and a member of cyclohexanones. It is functionally related to a 4-oxocyclohexanecarboxylic acid. |
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