butane; 2-methyl-2-phosphono-hexanoate

Systemtic Name: butane; 2-methyl-2-phosphono-hexanoate Openeye Name: butane; 2-methyl-2-phosphono-hexanoate CAS Name: butane; 2-methyl-2-phosphonohexanoate IUPAC Name: butane; 2-methyl-2-phosphonohexanoate Traditional Name: 2-methyl-2-phosphono-hexanoate; n-butane Formula: C11H24O5P- MolecularWeight: 267.279021

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.CCCCC(C)(C(=O)[O-])P(=O)(O)O

Isomeric SMILES

CCCC.CCCCC(C)(C(=O)[O-])P(=O)(O)O

InChI

InChI=1S/C7H15O5P.C4H10/c1-3-4-5-7(2,6(8)9)13(10,11)12;1-3-4-2/h3-5H2,1-2H3,(H,8,9)(H2,10,11,12);3-4H2,1-2H3/p-1