Compound Structure

1-Methoxy-2-propanol

CAS Number: 107-98-2

Molecular Mass: 90.12 g/mol

Formula: C4H10O2

Smiles: COCC(C)O

Melting point: 496.9 °C

Boiling point: 404.4 °C

Density: - g/cm3

Dipole moment: - D

Refractive index: 10.7017

Molecule 3D descriptors

Descriptor Value
PMI1 68.8478
PMI2 271.3393
PMI3 316.7764
NPR1 0.2173
NPR2 0.8566
RadiusOfGyration 1.9092
InertialShapeFactor 0.0124
Eccentricity 0.9761
Asphericity 0.4844
SpherocityIndex 0.2536
PBF 0.4955