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Structure

Potassium dodecanoate-2,2-d2

CAS
82867-25-2
Catalog Number
ACM82867252
Category
Other Products
Molecular Weight
240.41
Molecular Formula
C12H21D2KO2

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Specification

Synonyms
Potassium;2,2-dideuteriododecanoate
IUPAC Name
potassium;2,2-dideuteriododecanoate
Canonical SMILES
CCCCCCCCCCCC(=O)[O-].[K+]
InChI
InChI=1S/C12H24O2.K/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;/h2-11H2,1H3,(H,13,14);/q;+1/p-1/i11D2;
InChI Key
HIDKSOTTZRMUML-KGVUUENMSA-M
Chemical Formula
CH3(CH2)9CD2COOK
Complexity
138
Exact Mass
240.14606495
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
0
Heavy Atom Count
15
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
0
Isomeric SMILES
[2H]C([2H])(CCCCCCCCCC)C(=O)[O-].[K+]
Monoisotopic Mass
240.14606495
Rotatable Bond Count
10
Stability
Stable if stored under recommended conditions. After three years, the compound should be re-analyzed for chemical purity before use.
Storage Conditions
Room temperature
Topological Polar Surface Area
40.1 Ų
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