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80912-51-2

80912-51-2 Structure

80912-51-2 Structure
IdentificationBack Directory
[Name]

Methyl 1-(4-fluorophenyl)-4-oxocyclohexane-1-carboxylate
[CAS]

80912-51-2
[Synonyms]

Methyl 1-(4-fluorophenyl)-4-oxocyclohexane-1-carboxylate
Cyclohexanecarboxylic acid, 1-(4-fluorophenyl)-4-oxo-, methyl ester
[Molecular Formula]

C14H15FO3
[MDL Number]

MFCD22423113
[MOL File]

80912-51-2.mol
[Molecular Weight]

250.27
Chemical PropertiesBack Directory
[Boiling point ]

344.9±42.0 °C(Predicted)
[density ]

1.206±0.06 g/cm3(Predicted)
[form ]

solid
[InChI]

1S/C14H15FO3/c1-18-13(17)14(8-6-12(16)7-9-14)10-2-4-11(15)5-3-10/h2-5H,6-9H2,1H3
[InChIKey]

NCQFIBJQOZPYOI-UHFFFAOYSA-N
[SMILES]

O=C(OC)C(CC1)(C2=CC=C(F)C=C2)CCC1=O
Safety DataBack Directory
[WGK Germany ]

WGK 3
[HS Code ]

2914290090
[Storage Class]

11 - Combustible Solids
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