2-[(2R,4S)-2,4-dimethylheptyl]propane-1,3-diol

Systemtic Name: 2-[(2R,4S)-2,4-dimethylheptyl]propane-1,3-diol Openeye Name: 2-[(2R,4S)-2,4-dimethylheptyl]propane-1,3-diol CAS Name: 2-[(2R,4S)-2,4-dimethylheptyl]propane-1,3-diol IUPAC Name: 2-[(2R,4S)-2,4-dimethylheptyl]propane-1,3-diol Traditional Name: 2-[(2R,4S)-2,4-dimethylheptyl]propane-1,3-diol Formula: C12H26O2 MolecularWeight: 202.33364

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC(C)CC(CO)CO

Isomeric SMILES

CCC[C@H](C)C[C@@H](C)CC(CO)CO

InChI

InChI=1S/C12H26O2/c1-4-5-10(2)6-11(3)7-12(8-13)9-14/h10-14H,4-9H2,1-3H3/t10-,11+/m0/s1