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Home >> Chemical Listing >> Page 2104 >> (2,2-2H2)Octanoic acid

(2,2-2H2)Octanoic acid
[CAS# 64118-36-1]

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Identification
Name (2,2-2H2)Octanoic acid
Synonyms [156779-05-4]; [64118-36-1]; Caprylic acid
Molecular Structure CAS#: 64118-36-1, (2,2-<sup>2</sup>H<sub>2</sub>)Octanoic acid
Molecular Formula C8H14D2O2
Molecular Weight 146.22
CAS Registry Number 64118-36-1
SMILES [2H]C([2H])(CCCCCC)C(=O)O
InChI 1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)/i7D2
InChIKey WWZKQHOCKIZLMA-RJSZUWSASA-N
Properties
Density 0.942g/cm3 (Cal.)
Melting point 16°C (Expl.)
Boiling point 239.33°C at 760 mmHg (Cal.)
Flash point 107.379°C (Cal.)
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