D-Pinitol
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D-Pinitol

CAS 10284-63-6
Structure
Synonyms Pinit
IUPAC Name (1S,2S,4S,5R)-6-Methoxycyclohexane-1,2,3,4,5-pentol
Molecular Weight 194.18
Molecular Formula C7H14O6
Canonical SMILES COC1C(C(C(C(C1O)O)O)O)O
InChI InChI=1S/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3/t2?,3-,4-,5-,6+,7?/m0/s1
InChI Key DSCFFEYYQKSRSV-FEPQRWDDSA-N
Boiling Point 250.62 °C
Melting Point 179-185 °C(lit.)
Flash Point 145.6 °C
Purity 98%
Density 1.2501 g/cm³
Refractive Index 1.5600
pKa 12.98±0.70(Predicted)
Solubility in Water Soluble
Appearance Powder to crystal

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