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58706-66-4

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58706-66-4 Structure

58706-66-4 Structure

Identification	Back Directory
[Name] 2-OXOCYCLOHEXANECARBONITRILE
[CAS] 58706-66-4
[Synonyms] N-Acetyl-N-methyl-b-alanine N-acetyl-N-methyl-β-Alanine 2-OXOCYCLOHEXANECARBONITRILE N-Acetyl-N-methyl-Beta alanin b-Alanine, N-acetyl-N-methyl- N-Acetyl-N-Methyl-beta alanine 3-(N-methylacetamido)propanoic acid 3-[Acetyl(methyl)amino]propanoic acid 95+% 3-[Acetyl(methyl)amino]propionic acid, N-Acetyl-N-methyl-beta-alanine
[Molecular Formula] C6H11NO3
[MDL Number] MFCD00154839
[MOL File] 58706-66-4.mol
[Molecular Weight] 145.16

Chemical Properties	Back Directory
[Melting point ] 91～92℃
[Boiling point ] 150/15mm
[density ] 1.146±0.06 g/cm3(Predicted)
[storage temp. ] Store at Room Tem.
[form ] solid
[pka] 4.19±0.10(Predicted)
[color ] Pale yellow

Safety Data	Back Directory
[Symbol(GHS) ] GHS07
[Signal word ] Warning
[Hazard statements ] H315-H319-H227
[Precautionary statements ] P501-P210-P264-P280-P302+P352-P370+P378-P337+P313-P305+P351+P338-P362+P364-P332+P313-P403+P235
[Hazard Note ] Irritant
[HS Code ] 2922500090

Hazard Information	Back Directory
[Uses] N-acetyl-N-methyl-β-Alanine is a useful building block, which has been used in the synthesis of isoxazole carboxamides as growth hormone antagonists.
[Synthesis Reference(s)] Tetrahedron Letters, 25, p. 753, 1984 DOI: 10.1016/S0040-4039(01)80017-4

Spectrum Detail	Back Directory
[Spectrum Detail] 2-OXOCYCLOHEXANECARBONITRILE(58706-66-4)MS 2-OXOCYCLOHEXANECARBONITRILE(58706-66-4)IR1 2-OXOCYCLOHEXANECARBONITRILE(58706-66-4)IR2

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