Chem
J-GLOBAL ID:200907095745507205   Nikkaji number:J1.046.749G

Calcium[2,2′-(2-furylmethylene)bis(4-dodecylphenolate)]

カルシウム[2,2′-(2-フリルメチレン)ビス(4-ドデシルフェノラート)]
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C41H60CaO3
Molecular formula furigana: C41-H60-CA-O3
Molecular weight: 641.006
InChI: InChI=1S/C41H62O3.Ca/c1-3-5-7-9-11-13-15-17-19-21-24-34-27-29-38(42)36(32-34)41(40-26-23-31-44-40)37-33-35(28-30-39(37)43)25-22-20-18-16-14-12-10-8-6-4-2;/h23,26-33,41-43H,3-22,24-25H2,1-2H3;/q;+2/p-2
InChI key: CPKZSGJYKZEAAU-UHFFFAOYSA-L
SMILES: CCCCCCCCCCCCc1ccc2O[Ca]Oc3ccc(CCCCCCCCCCCC)cc3C(c3ccco3)c2c1
Systematic name  (3):
  • カルシウム[2,2′-(2-フリルメチレン)ビス(4-ドデシルフェノラート)]
  • 5,15-ジドデシル-2-(フラン-2-イル)-9,11-ジオキサ-10-カルカトリシクロ[10.4.0.03,8]ヘキサデカ-1(16),3,5,7,12,14-ヘキサエン
  • 5,15-didodecyl-2-(furan-2-yl)-9,11-dioxa-10-calcatricyclo[10.4.0.03,8]hexadeca-1(16),3,5,7,12,14-hexaene
Other name (1):
  • Calcium[2,2′-(2-furylmethylene)bis(4-dodecylphenolate)]
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