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About This Item
線性公式:
CD3(CD2)6CD3
CAS號碼:
分子量：:
132.34
EC號碼:
MDL號碼:
分類程式碼代碼:
12142201
PubChem物質ID:
NACRES:
NA.21
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同位素純度
98 atom % D
品質等級
化驗
99% (CP)
形狀
liquid
expl. lim.
0.34-6.3 % (lit.)
技術
NMR: suitable
折射率
n20/D 1.394 (lit.)
bp
125-127 °C
mp
-57 °C (lit.)
密度
0.815 g/mL at 25 °C (lit.)
質量偏移
M+18
SMILES 字串
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]
InChI
1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2,7D2,8D2
InChI 密鑰
TVMXDCGIABBOFY-VAZJTQEUSA-N
一般說明
Octane-d18 is a deuterated NMR solvent. It is useful in NMR-based research and analyses. It can be prepared starting from n-octane. It undergoes H/D (Hydrogen/Deuterium) exchange reaction with mono pinacolboryl complex at 110°C.
應用
Octane-d18 has been used to evaluate the separation factors of the deuterated octane isomers by gas chromatography (GC).
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訊號詞
Danger
危險分類
Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3
標靶器官
Central nervous system
儲存類別代碼
3 - Flammable liquids
水污染物質分類（WGK）
WGK 2
閃點（°F）
55.4 °F - closed cup
閃點（°C）
13 °C - closed cup
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The Synthesis and Properties of n-Octane-d18 and 2, 2, 4-Trimethylpentane-d181.
Dixon JA and Marr JW.
The Journal of Organic Chemistry, 28(11), 3085-3087 (1963)
Deuterium Tracer Studies and Gas Chromatography-Mass Spectrometry Analysis of Deuterated Products during Fischer-Tropsch Synthesis.
Shi B, et al.
Topics in Catalysis, 57(6-9), 460-469 (2014)
Gregory P Horne et al.
Dalton transactions (Cambridge, England : 2003), 48(30), 11547-11555 (2019-07-12)
We report a 31P NMR investigation into the activated radioprotection mechanism of octylphenyl-N,N-diisobutyl-carbamoylmethyl phosphine oxide (CMPO) and analogues in the presence of a gamma radiation field. CMPO exhibits significantly enhanced radiation resistance in the presence of high nitric acid concentrations
Catalytic, thermal, regioselective functionalization of alkanes and arenes with borane reagents.
Hartwig JF.
ACS Symp. Ser., 136-154 (2004)
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