Molecule ID: 8771

IUPAC Name: (7-ethyl-2-methylundecan-4-yl) hydrogen sulfate

Description: The molecule is an alkyl sulfate that is the mono-7-ethyl-2-methylundecan-4-yl ester of sulfuric acid. It is a conjugate base of a tetradecyl sulfate.

SMILES: CCCCC(CC)CCC(CC(C)C)OS(=O)(=O)O

SELFIES: [C][C][C][C][C][Branch1][Ring1][C][C][C][C][C][Branch1][#Branch1][C][C][Branch1][C][C][C][O][S][=Branch1][C][=O][=Branch1][C][=O][O]

InChI: InChI=1S/C14H30O4S/c1-5-7-8-13(6-2)9-10-14(11-12(3)4)18-19(15,16)17/h12-14H,5-11H2,1-4H3,(H,15,16,17)

Molecular Properties:
- Polar Surface Area: 72.0 Ų
- LogP: 5.1