456322
2,2,4-Trimethylpentane-d18
98 atom % D
Synonym(s):
Isooctane-d18
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About This Item
InChI
1S/C8H18/c1-7(2)6-8(3,4)5/h7H,6H2,1-5H3/i1D3,2D3,3D3,4D3,5D3,6D2,7D
SMILES string
[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]
InChI key
NHTMVDHEPJAVLT-FKVAJJEHSA-N
isotopic purity
98 atom % D
assay
99% (CP)
refractive index
n20/D 1.387 (lit.)
bp
98-99 °C (lit.)
mp
-107 °C (lit.)
density
0.820 g/mL at 25 °C
mass shift
M+18
Quality Level
Related Categories
Packaging
signalword
Danger
hcodes
Hazard Classifications
Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Central nervous system
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
10.4 °F
flash_point_c
-12.00 °C
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