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Ethanol-d6

CAT: 0931-T206625-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T206625-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1516-08-1
Bioactivity
Ethanol-d6 is the deuterium-labeled form of ethanol.
Smiles
C(C([2H])([2H])[2H])(O[2H])([2H])[2H]
Molecular Formula
C2H6O
Molecular Weight
52.105
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ethyl alcohol-d6

Ethanol-d6 is a volatile organic compound, a member of ethanols, an alkyl alcohol and a deuterated compound. It has a role as a NMR solvent.

CAS Number1516-08-1
PubChem CID102138
IUPAC Name1,1,1,2,2-pentadeuterio-2-deuteriooxyethane
Molecular FormulaC2H6O
Molecular Weight52.11
XLogP-0.1
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count3
Formal Charge0
Complexity2
SMILES
[2H]C([2H])([2H])C([2H])([2H])O[2H]
InChI
InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3/i1D3,2D2,3D
InChIKey
LFQSCWFLJHTTHZ-LIDOUZCJSA-N
Chemical Structure
2D Structure
2D structure of Ethyl alcohol-d6
CAS: 1516-08-1
CID: 102138
Formula: C2H6O
MW: 52.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight52.11
XLogP3-0.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass52.079525286
Monoisotopic Mass52.079525286
Topological Polar Surface Area20.2 Ų
Heavy Atom Count3
Formal Charge0
Complexity2.8
Isotope Atom Count6
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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DE255CEthanol-D6 >99.0 Atom % D 1 pack = 10ml bottle
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