1-oxidanylpropane-1,1,3-tricarboxylic acid hydrate

Systemtic Name: 1-oxidanylpropane-1,1,3-tricarboxylic acid hydrate Openeye Name: 1-hydroxypropane-1,1,3-tricarboxylic acid hydrate CAS Name: 1-hydroxypropane-1,1,3-tricarboxylic acid hydrate IUPAC Name: 1-hydroxypropane-1,1,3-tricarboxylic acid hydrate Traditional Name: 1-hydroxypropane-1,1,3-tricarboxylic acid hydrate Formula: C6H10O8 MolecularWeight: 210.1388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)O)(C(=O)O)O)C(=O)O.O

Isomeric SMILES

C(CC(C(=O)O)(C(=O)O)O)C(=O)O.O

InChI

InChI=1S/C6H8O7.H2O/c7-3(8)1-2-6(13,4(9)10)5(11)12;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);1H2