(1-oxidanyl-1-phosphono-butyl)phosphonic acid; pentan-1-amine

Systemtic Name: (1-oxidanyl-1-phosphono-butyl)phosphonic acid; pentan-1-amine Openeye Name: (1-hydroxy-1-phosphono-butyl)phosphonic acid; pentan-1-amine CAS Name: (1-hydroxy-1-phosphonobutyl)phosphonic acid; 1-pentanamine IUPAC Name: (1-hydroxy-1-phosphonobutyl)phosphonic acid; pentan-1-amine Traditional Name: amylamine; (1-hydroxy-1-phosphono-butyl)phosphonic acid Formula: C9H25NO7P2 MolecularWeight: 321.244822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN.CCCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCCN.CCCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C5H13N.C4H12O7P2/c1-2-3-4-5-6;1-2-3-4(5,12(6,7)8)13(9,10)11/h2-6H2,1H3;5H,2-3H2,1H3,(H2,6,7,8)(H2,9,10,11)