303003
Hexane-d14
99 atom % D
Synonym(s):
Tetradecadeuterohexane
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About This Item
Linear Formula:
CD3(CD2)4CD3
CAS Number:
Molecular Weight:
100.26
UNSPSC Code:
12142201
NACRES:
NA.21
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
1841418
Isotopic purity:
99 atom % D
Assay:
99% (CP)
Mass shift:
M+14
Form:
liquid
vapor density
3 (vs air)
Quality Level
vapor pressure
132 mmHg ( 20 °C)
isotopic purity
99 atom % D
assay
99% (CP)
form
liquid
expl. lim.
7.7 %
technique(s)
NMR: suitable
impurities
≤0.5% water
water
refractive index
n20/D 1.3718 (lit.)
bp
69 °C
mp
-95 °C (lit.)
density
0.767 g/mL at 25 °C (lit.)
mass shift
M+14
SMILES string
[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]
InChI
1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3/i1D3,2D3,3D2,4D2,5D2,6D2
InChI key
VLKZOEOYAKHREP-ZLKPZJALSA-N
General description
Hexane-d14 is a deuterated NMR solvent that is useful in NMR-based research and analyses.
Other Notes
Check out ChemisTwin®, our brand new online portal for identity confirmation and quantification of NMR spectra. Learn more or reach out to us for a free trial.
signalword
Danger
Hazard Classifications
Aquatic Chronic 2 - Asp. Tox. 1 - Flam. Liq. 2 - Repr. 2 - Skin Irrit. 2 - STOT RE 2 Inhalation - STOT SE 3
target_organs
Central nervous system, Nervous system
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
10.4 °F - closed cup
flash_point_c
-12 °C - closed cup
Regulatory Information
危险化学品
美国出口管控产品
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Related Content
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Vibration spectra and rotational isomerism of chain molecules. II. Butane, pentane, hexane, pentane-d12, and hexane-d14.
Harada I, et al.
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| 303003-1G | 04061837614156 |
| 303003-5G | 04061837614163 |