Cas no 17200-48-5 (Calcium dibenzyl dimaleate)

Calcium dibenzyl dimaleate structure
Calcium dibenzyl dimaleate structure
Product Name:Calcium dibenzyl dimaleate
CAS No:17200-48-5
MF:C22H18CaO8
MW:450.451526165009
CID:232741
Update Time:2023-08-03

Calcium dibenzyl dimaleate Chemical and Physical Properties

Names and Identifiers

    • 2-Butenedioic acid(2Z)-, mono(phenylmethyl) ester, calcium salt (9CI)
    • Calcium dibenzyl dimaleate
    • Bis[(Z)-4-(benzyloxy)-4-oxo-2-butenoic acid] calcium salt
    • Inchi: 1S/2C11H10O4.Ca/c2*12-10(13)6-7-11(14)15-8-9-4-2-1-3-5-9;/h2*1-7H,8H2,(H,12,13);/q;;+2/p-2/b2*7-6-;
    • InChI Key: YDFZSTMOFBLSJC-SVDRMMRJSA-L
    • SMILES: [Ca+2].O(C(/C=C\C(=O)[O-])=O)CC1C=CC=CC=1.O(C(/C=C\C(=O)[O-])=O)CC1C=CC=CC=1

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 8
  • Complexity: 246
  • Topological Polar Surface Area: 133
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