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(2H11)Hexanoic acid
[CAS# 95348-44-0]

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Identification
Name (2H11)Hexanoic acid
Synonyms Caproic Acid; Caproic acid-d11,OH; Hexanoic-d11 Acid
Molecular Structure CAS#: 95348-44-0, (<sup>2</sup>H<sub>11</sub>)Hexanoic acid
Molecular Formula C6HD11O2
Molecular Weight 127.23
CAS Registry Number 95348-44-0
SMILES [2H]C([2H])(C([2H])([2H])C(=O)O)C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]
InChI 1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)/i1D3,2D2,3D2,4D2,5D2
InChIKey FUZZWVXGSFPDMH-GILSBCIXSA-N
Properties
Density 1.041g/cm3 (Cal.)
Boiling point 204.619°C at 760 mmHg (Cal.)
Flash point 90.311°C (Cal.)
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