233331
Acetonitrile-d3
99.8 atom % D, contains 1 % (v/v) TMS
Synonym(s):
Methyl-d3 cyanide, Trideuteroacetonitrile
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About This Item
Linear Formula:
CD3CN
CAS Number:
Molecular Weight:
44.07
UNSPSC Code:
12142201
NACRES:
NA.21
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
1740230
Isotopic purity:
99.8 atom % D
Assay:
99% (CP)
Mass shift:
M+3
Form:
liquid
isotopic purity
99.8 atom % D
Quality Level
assay
99% (CP)
form
liquid
contains
1 % (v/v) TMS
expl. lim.
3.0-16 % (lit.)
technique(s)
NMR: suitable
refractive index
n20/D 1.341 (lit.)
bp
80.7 °C (lit.)
mp
-46 °C (lit.)
density
0.844 g/mL at 25 °C (lit.)
mass shift
M+3
SMILES string
[2H]C([2H])([2H])C#N
InChI
1S/C2H3N/c1-2-3/h1H3/i1D3
InChI key
WEVYAHXRMPXWCK-FIBGUPNXSA-N
Other Notes
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signalword
Danger
Hazard Classifications
Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Flam. Liq. 2
Storage Class
3 - Flammable liquids
flash_point_f
42.8 °F - closed cup
flash_point_c
6 °C - closed cup
Regulatory Information
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J. Chem. Phys., 100(11), 8347-8358 (1994)
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J. Chem. Phys. , 47(9), 3621-3626 (1967)
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 233331-50G | 04061837655463 |