ChemicalBook--->CAS DataBase List--->28246-87-9

28246-87-9

28246-87-9 Structure

28246-87-9 Structure
IdentificationBack Directory
[Name]

1-CYANOCYCLOBUTANECARBOXYLIC ACID ETHYL ESTER
[CAS]

28246-87-9
[Synonyms]

ethyl 1-cyanocyclobutanecarboxylate
Ethyl 1-cyanocyclobutane-1-carboxylate
1-CYANOCYCLOBUTANECARBOXYLIC ACID ETHYL ESTER
1-Cyano-Cyclobutanecarboxylic Acid Ethyl Este
Cyclobutanecarboxylic acid, 1-cyano-, ethyl ester
(Z)-3-hydroxy-1-[5-(thiophen-2-ylmethyl)-2-furanyl]-3-(1H-1,2,4-triazol-5-yl)-2-propen-1-one
[Molecular Formula]

C8H11NO2
[MDL Number]

MFCD04114273
[MOL File]

28246-87-9.mol
[Molecular Weight]

153.18
Chemical PropertiesBack Directory
[Boiling point ]

215.5-216 °C(Press: 762 Torr)
[density ]

1.09±0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332
[Precautionary statements ]

P280-P301+P312-P302+P352
Hazard InformationBack Directory
[Uses]

1-CYANOCYCLOBUTANECARBOXYLIC ACID ETHYL ESTER can be used as organic synthesis intermediate and pharmaceutical intermediate, mainly used in laboratory research and development process and chemical and pharmaceutical production process.
[Synthesis]


4-(9>-cyclopentyl-5'-methyl-6>-oxo-5>,6>,8>,9>- tetrahydrospiro[cyclobutane-l,7'-pyrimido[4,5-b][l,4]diazepine]-2'-ylamino)-3- methoxybenzoic acid; [0521] Ethyl 1-cyanocyclobutanecarboxylate; To a solution of sodium ethoxide (21wt% in EtOH, 5.79 rnL, 15.5 mmol) in EtOH (25 mL), was added ethyl cyanoacetate(1.12 mL, 10.5 mmol), followed shortly thereafter by 1,1-dibromopropane (1.12 mL, 10 mmol). The reaction mixture was refluxed for 3 hrs. It was then concentrated, and diluted to ethyl acetate. The organic layer was washed with NaHCCh, brine, water, dried over Na2SO4 and concentrated in vacuo to obtain ethyl 1-cyanocyclobutanecarboxylate (1.17 g, 74% yield) as a red liquid. It was used directly for next step reaction. 
Spectrum DetailBack Directory
[Spectrum Detail]

1-CYANOCYCLOBUTANECARBOXYLIC ACID ETHYL ESTER(28246-87-9)1HNMR
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