Chemical Properties of Myo-Inositol (CAS 87-89-8)

Myo-Inositol

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InChI
InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H
InChI Key
CDAISMWEOUEBRE-UHFFFAOYSA-N
Formula
C6H12O6
SMILES
OC1C(O)C(O)C(O)C(O)C1O
Molecular Weight1
180.16
CAS
87-89-8
Other Names
  • Bios I
  • Cyclohexanehexol
  • Cyclohexitol
  • Dambose
  • Hexahydroxycyclohexane
  • Inosital
  • Inosite
  • Inositene
  • Inositina
  • Inositol, meso-
  • Inositol, myo-
  • MI
  • Meat sugar
  • Mesoinosit
  • Mesoinosite
  • Mesol
  • Mesovit
  • Mouse antialopecia factor
  • Muscle sugar
  • Myoinosite
  • Nucite
  • Phaseomannite
  • Phaseomannitol
  • Rat antispectacled eye factor
  • Scyllite
  • cis-1,2,3,5-trans-4,6-Cyclohexanehexol
  • i-Inositol
  • iso-Inositol
  • meso-Inositol
Sources

Physical Properties

Property Value Unit Source
Δf -835.38 kJ/mol Joback Calculated Property
Δfgas -1127.93 kJ/mol Joback Calculated Property
Δfus 33.01 kJ/mol Joback Calculated Property
Δsub 161.00 kJ/mol NIST
Δsub 178.00 kJ/mol NIST
Δvap 127.91 kJ/mol Joback Calculated Property
logPoct/wat -3.83 Crippen Calculated Property
Pc 6921.35 kPa Joback Calculated Property
Tboil 885.96 K Joback Calculated Property
Tc 1086.32 K Joback Calculated Property
Tfus 496.90 ± 0.20 K NIST
Vc 0.41 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 437.69 J/mol×K 885.96 Joback Calculated Property
Cp,solid 218.31 J/mol×K 298.15 NIST
η 0.00 Pa×s 885.96 Joback Calculated Property
ΔfusH 47.90 kJ/mol 496.9 NIST
ΔfusH 47.90 kJ/mol 496.9 NIST
ΔfusH 47.90 kJ/mol 496.9 NIST
ΔsubH 174.00 ± 2.60 kJ/mol 448.0 NIST
ΔsubH 168.00 kJ/mol 463.0 NIST
ΔsubH 154.70 ± 1.40 kJ/mol 477.0 NIST
ΔvapH 119.00 ± 1.40 kJ/mol 510.5 NIST
ΔfusS 96.40 J/mol×K 496.9 NIST

Molecular Descriptors

Joback and Reid Groups
-OH (alcohol) 6
>CH- (ring) 6

Similar Compounds

Epi-Inositol. Scyllo-Inositol. Allo-Inositol. Quercitol. Muco-Inositol. Chiro-inositol. Galactitol. Sorbitol. D-Mannitol. L-Mannitol. 1,2,3-Cyclohexanetriol. D-Arabinitol. L-Arabinitol. Xylitol. arabinitol.

Find more compounds similar to Myo-Inositol.

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