3997-89-5

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3997-89-5 Structure

Identification	Back Directory
[Name] CYCLOPENTANONE-2,2,5,5-D4
[CAS] 3997-89-5
[Synonyms] Yclopentanone-2,2,5,5-d4 CYCLOPENTANONE-2,2,5,5-D4 Cyclopentanone-2,2,5,5-d? (2,2,5,5-2H4)Cyclopentan-1-one 2,2,5,5-tetradeuteriocyclopentan-1-one Cyclopentanone-2,2,5,5-d4(6CI,8CI,9CI) CYCLOPENTANONE-2,2,5,5-D4, 98 ATOM % D
[Molecular Formula] C5H4D4O
[MDL Number] MFCD00190415
[MOL File] 3997-89-5.mol
[Molecular Weight] 88.14

Chemical Properties	Back Directory
[Melting point ] −51 °C(lit.)
[Boiling point ] 130-131 °C(lit.)
[density ] 0.996 g/mL at 25 °C
[refractive index ] n20/D 1.437(lit.)
[Fp ] 87 °F
[storage temp. ] Store at room temperature
[Appearance] Colorless to light yellow Liquid
[Sensitive ] Air Sensitive
[InChI] 1S/C5H8O/c6-5-3-1-2-4-5/h1-4H2/i3D2,4D2
[InChIKey] BGTOWKSIORTVQH-KHORGVISSA-N
[SMILES] [2H]C1([2H])CCC([2H])([2H])C1=O

Safety Data	Back Directory
[Hazard Codes ] Xn
[Risk Statements ] 10-20/21/22-36/37-41
[Safety Statements ] 16-26-36
[RIDADR ] UN 2245 3/PG 3
[WGK Germany ] 3
[HazardClass ] 3
[Storage Class] 3 - Flammable liquids
[Hazard Classifications] Eye Irrit. 2 Flam. Liq. 3 Skin Irrit. 2

Hazard Information	Back Directory
[Uses] Cyclopentanone-2,2,5,5-d4 (CAS# 3997-89-5) is a useful isotopically labeled research compound.

Spectrum Detail	Back Directory
[Spectrum Detail] CYCLOPENTANONE-2,2,5,5-D4(3997-89-5)¹HNMR

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