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51685-57-5

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51685-57-5 Structure

51685-57-5 Structure

Identification	Back Directory
[Name] 2,2,4-TRIMETHYLPENTANE-D18
[CAS] 51685-57-5
[Synonyms] ISOOCTANE (D18) 2,2,4-TRIMETHYLPENTANE-D18 2,2,4-TRIMETHYLPENTANE-D18, 98 ATOM % D
[Molecular Formula] C8D18
[MDL Number] MFCD00142748
[MOL File] 51685-57-5.mol
[Molecular Weight] 132.34

Chemical Properties	Back Directory
[Melting point ] -107 °C (lit.)
[Boiling point ] 98-99 °C (lit.)
[density ] 0.820 g/mL at 25 °C
[refractive index ] n20/D 1.387(lit.)
[Fp ] 18 °F
[InChI] 1S/C8H18/c1-7(2)6-8(3,4)5/h7H,6H2,1-5H3/i1D3,2D3,3D3,4D3,5D3,6D2,7D
[InChIKey] NHTMVDHEPJAVLT-FKVAJJEHSA-N
[SMILES] [2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])C([2H])([2H])C(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]
[CAS Number Unlabeled] 540-84-1

Safety Data	Back Directory
[Symbol(GHS) ] GHS02,GHS07,GHS08,GHS09
[Signal word ] Danger
[Hazard statements ] H225-H304-H315-H336-H410
[Precautionary statements ] P210-P233-P273-P301+P310-P303+P361+P353-P331
[Hazard Codes ] F,Xn,N
[Risk Statements ] 11-20/22-36/37/38-67-65-50/53-38
[Safety Statements ] 16-26-33-36/37/39-61-60-29-9
[RIDADR ] UN 1262 3/PG 2
[WGK Germany ] 3
[Storage Class] 3 - Flammable liquids
[Hazard Classifications] Aquatic Acute 1 Aquatic Chronic 1 Asp. Tox. 1 Flam. Liq. 2 Skin Irrit. 2 STOT SE 3

Spectrum Detail	Back Directory
[Spectrum Detail] 2,2,4-TRIMETHYLPENTANE-D18(51685-57-5)FT-IR

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540-84-1