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Structure

Acetic-2,2,2-d3 acid,ethyl-1,1,2,2,2-d5 ester

CAS
117121-81-0
Catalog Number
ACM117121810
Category
Other Products
Molecular Weight
96.15
Molecular Formula
C4D8O2

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Specification

Synonyms
Ethyl acetate-d8, Ethyl-d5 acetate-d3, 522899_ALDRICH, AKOS015910572, I14-39838, 117121-81-0
IUPAC Name
1,1,2,2,2-pentadeuterioethyl 2,2,2-trideuterioacetate
Canonical SMILES
CCOC(=O)C
InChI Key
XEKOWRVHYACXOJ-AUOAYUKBSA-N
Boiling Point
77ºC(lit.)
Melting Point
-84ºC(lit.)
Flash Point
-3ºC
Density
0.984 g/mL at 25ºC
Exact Mass
96.10260
Hazard Statements
F: Flammable;Xi: Irritant;
H-Bond Acceptor
2
H-Bond Donor
0
Safety Description
16-26-36/37/39
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