Compound Structure

1-Propoxy-2-propanol

CAS Number: 1569-01-3

Molecular Mass: 118.17 g/mol

Formula: C6H14O2

Smiles: CCCOCC(C)O

Melting point: - °C

Boiling point: 150.2 °C

Density: - g/cm3

Dipole moment: - D

Refractive index: 10.7065

Molecule 3D descriptors

Descriptor Value
PMI1 111.6261
PMI2 607.4948
PMI3 685.6925
NPR1 0.1628
NPR2 0.8860
RadiusOfGyration 2.4380
InertialShapeFactor 0.0079
Eccentricity 0.9867
Asphericity 0.5894
SpherocityIndex 0.2040
PBF 0.5113