Products 250141-42-5

CAS 250141-42-5 is the registry number for CALCIUM FRUCTOBORATE. Offered by: Chemat. Available pack sizes: 5g, 25g, 100g, 500g.

Structural formula: {0} (CAS {1})

Calcium bis((1S,1'S,5R,5'R,7R,7'R,8S,8'S)-5,5',7,7'-tetrakis(hydroxymethyl)-3,3'-spirobi[2,4,6-trioxa-3-boranuidabicyclo[3.3.0]octane]-8,8'-diol) (CAS 250141-42-5) is a chemical compound with the molecular formula C24H40B2CaO24 and a molecular weight of 774.3 g/mol. IUPAC name: calcium bis((1S,1'S,5R,5'R,7R,7'R,8S,8'S)-5,5',7,7'-tetrakis(hydroxymethyl)-3,3'-spirobi[2,4,6-trioxa-3-boranuidabicyclo[3.3.0]octane]-8,8'-diol). InChIKey: HRSMKOBEJUELDV-XBNRZDKMSA-N.

Identity
Molecular formulaC24H40B2CaO24
Molecular weight774.3 g/mol
IUPAC namecalcium bis((1S,1'S,5R,5'R,7R,7'R,8S,8'S)-5,5',7,7'-tetrakis(hydroxymethyl)-3,3'-spirobi[2,4,6-trioxa-3-boranuidabicyclo[3.3.0]octane]-8,8'-diol)
InChIKeyHRSMKOBEJUELDV-XBNRZDKMSA-N
SMILES[B-]12(O[C@H]3[C@@H]([C@H](O[C@]3(O1)CO)CO)O)O[C@H]4[C@@H]([C@H](O[C@]4(O2)CO)CO)O.[B-]12(O[C@H]3[C@@H]([C@H](O[C@]3(O1)CO)CO)O)O[C@H]4[C@@H]([C@H](O[C@]4(O2)CO)CO)O.[Ca+2]

Computed by PubChem (NCBI)