D-sorbitol

Compound Structure

CAS Number: 50-70-4

Molecular Mass: 182.17 g/mol

Formula: C6H14O6

Smiles: OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO

Synonymes:

Bioactivity: -

Solubility in Different Solvents

Solvent Temperature [K] Crystal form Solubility [mg/mL] Reference
1-Butanol 278.15 - 0.9065 [181]
1-Butanol 283.15 - 1.071 [181]
1-Butanol 288.15 - 1.254 [181]
1-Butanol 293.15 - 1.489 [181]
1-Butanol 298.15 - 1.774 [181]
1-Butanol 303.15 - 2.09 [181]
1-Propanol 278.15 - 1.369 [181]
1-Propanol 283.15 - 1.667 [181]
1-Propanol 288.15 - 2.053 [181]
1-Propanol 293.15 - 2.482 [181]
1-Propanol 298.15 - 3.004 [181]
1-Propanol 303.15 - 3.667 [181]
Acetone 278.15 - 0.5699 [181]
Acetone 283.15 - 0.6416 [181]
Acetone 288.15 - 0.7171 [181]
Acetone 293.15 - 0.8131 [181]
Acetone 298.15 - 0.9407 [181]
Acetone 303.15 - 1.066 [181]
Acetonitrile 278.15 - 0.3864 [181]
Acetonitrile 283.15 - 0.4542 [181]
Acetonitrile 288.15 - 0.535 [181]
Acetonitrile 293.15 - 0.618 [181]
Acetonitrile 298.15 - 0.7171 [181]
Acetonitrile 303.15 - 0.8525 [181]
Ethanol 278.15 - 1.899 [181]
Ethanol 283.15 - 2.377 [181]
Ethanol 288.15 - 2.964 [181]
Ethanol 293.15 - 3.651 [181]
Ethanol 298.15 - 4.551 [181]
Ethanol 303.15 - 5.587 [181]
Ethyl acetate 278.15 - 0.454 [181]
Ethyl acetate 283.15 - 0.489 [181]
Ethyl acetate 288.15 - 0.5418 [181]
Ethyl acetate 293.15 - 0.5904 [181]
Ethyl acetate 298.15 - 0.6549 [181]
Ethyl acetate 303.15 - 0.7203 [181]
Methanol 278.15 - 9.404 [181]
Methanol 283.15 - 12.55 [181]
Methanol 288.15 - 15.94 [181]
Methanol 293.15 - 20.83 [181]
Methanol 298.15 - 26.32 [181]
Methanol 303.15 - 33.09 [181]
Tetrahydrofuran 278.15 - 0.8296 [181]
Tetrahydrofuran 283.15 - 0.9222 [181]
Tetrahydrofuran 288.15 - 1.007 [181]
Tetrahydrofuran 293.15 - 1.097 [181]
Tetrahydrofuran 298.15 - 1.213 [181]
Tetrahydrofuran 303.15 - 1.323 [181]

Molecule 3D descriptors

Descriptor Value
PMI1 291.9907
PMI2 1084.1089
PMI3 1170.1339
NPR1 0.2495
NPR2 0.9265
RadiusOfGyration 2.6436
InertialShapeFactor 0.0032
Eccentricity 0.9684
Asphericity 0.4337
SpherocityIndex 0.3573
PBF 0.8451