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About This Item
Empirical Formula (Hill Notation):
C4D8O2
CAS Number:
Molecular Weight:
96.15
UNSPSC Code:
12142201
NACRES:
NA.21
PubChem Substance ID:
EC Number:
241-628-7
Beilstein/REAXYS Number:
1307286
MDL number:
Isotopic purity:
≥99 atom % D
Assay:
≥99% (CP)
Mass shift:
M+8
Form:
liquid
isotopic purity
≥99 atom % D
Quality Segment
assay
≥99% (CP)
form
liquid
technique(s)
NMR: suitable
refractive index
n
bp
99 °C (lit.)
mp
12 °C (lit.)
density
1.129 g/mL at 25 °C (lit.)
mass shift
M+8
SMILES string
[2H]C1([2H])OC([2H])([2H])C([2H])([2H])OC1([2H])[2H]
InChI
1S/C4H8O2/c1-2-6-4-3-5-1/h1-4H2/i1D2,2D2,3D2,4D2
InChI key
RYHBNJHYFVUHQT-SVYQBANQSA-N
Application
Deuterated solvents are indispensable wherever chemical research is carried out, supporting nuclear magnetic resonance (NMR) spectroscopy - the leading method for structural elucidation of organic molecules. As a non-destructive, information-rich technique, NMR reveals atomic connectivity within a molecule, its spatial orientation, and its motion in its natural environment, offering a comprehensive picture of molecular structure and dynamics.
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Signal Word
Danger
Hazard Codes
Precautionary Statements
Hazard Classifications
Carc. 1B - Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3
Target Organs
Respiratory system
supp_hazards
Storage Class
3 - Flammable liquids
WGK
WGK 3
Flash Point (°F)
41.0 °F - closed cup
Flash Point (°C)
5 °C - closed cup
PPE (personal protective equipment)
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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