[3-ethoxycarbonyl-4-(hydroxymethyl)hexan-3-yl]phosphonic acid

Systemtic Name: [3-ethoxycarbonyl-4-(hydroxymethyl)hexan-3-yl]phosphonic acid Openeye Name: [1-ethoxycarbonyl-1-ethyl-2-(hydroxymethyl)butyl]phosphonic acid CAS Name: [3-ethoxycarbonyl-4-(hydroxymethyl)hexan-3-yl]phosphonic acid IUPAC Name: [3-ethoxycarbonyl-4-(hydroxymethyl)hexan-3-yl]phosphonic acid Traditional Name: (1-carbethoxy-1-ethyl-2-methylol-butyl)phosphonic acid Formula: C10H21O6P MolecularWeight: 268.243901

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)C(CC)(C(=O)OCC)P(=O)(O)O

Isomeric SMILES

CCC(CO)C(CC)(C(=O)OCC)P(=O)(O)O

InChI

InChI=1S/C10H21O6P/c1-4-8(7-11)10(5-2,17(13,14)15)9(12)16-6-3/h8,11H,4-7H2,1-3H3,(H2,13,14,15)