2-methylicosan-3-ylphosphonic acid

Systemtic Name: 2-methylicosan-3-ylphosphonic acid Openeye Name: 1-isopropyloctadecylphosphonic acid CAS Name: 2-methyleicosan-3-ylphosphonic acid IUPAC Name: 2-methylicosan-3-ylphosphonic acid Traditional Name: 1-isopropyloctadecylphosphonic acid Formula: C21H45O3P MolecularWeight: 376.553961

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(C(C)C)P(=O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(C(C)C)P(=O)(O)O

InChI

InChI=1S/C21H45O3P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(20(2)3)25(22,23)24/h20-21H,4-19H2,1-3H3,(H2,22,23,24)