Molecule ID: 6455816

IUPAC Name: 1-[3-(2-hydroxypropoxy)-2,2-bis(2-hydroxypropoxymethyl)propoxy]propan-2-ol

Description: The molecule is a hydroxypolyether in which a hydroxy-poly(propylene oxide) chain is connected to each of the methyl groups of neopentane. It is commonly used to crystallise proteins. In the diagram, a + b + c + d ~ 5. It has a role as a crystallisation adjutant.

SMILES: CC(O)COCC(COCC(C)O)(COCC(C)O)COCC(C)O

SELFIES: [C][C][Branch1][C][O][C][O][C][C][Branch1][=Branch2][C][O][C][C][Branch1][C][C][O][Branch1][=Branch2][C][O][C][C][Branch1][C][C][O][C][O][C][C][Branch1][C][C][O]

InChI: InChI=1S/C17H36O8/c1-13(18)5-22-9-17(10-23-6-14(2)19,11-24-7-15(3)20)12-25-8-16(4)21/h13-16,18-21H,5-12H2,1-4H3

Molecular Properties:
- Polar Surface Area: 118.0 Ų
- LogP: -1.3