Zirconium tetrakis(2,2,6,6-tetramethyl-3,5-heptanedionate)

HCID 6287074

部分構造検索類似構造を探す

基本情報

標準SMILES: CC(C)(C)C(=O)/C=C(\O)C(C)(C)C.CC(C)(C)C(=O)/C=C(\O)C(C)(C)C.CC(C)(C)C(=O)/C=C(\O)C(C)(C)C.CC(C)(C)C(=O)/C=C(\O)C(C)(C)C.[Zr]
InChIKey: ANBXKEDJQLYCLX-DNSQIVDOSA-N
分子式: C44H80O8Zr
平均分子量: 828.3 g/mol

概要

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名称と識別子

優先名称: Zirconium tetrakis(2,2,6,6-tetramethyl-3,5-heptanedionate)
IUPAC: tetrakis((Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one);zirconium

名称と別名

RefChem:905257Zirconium tetrakis(2,2,6,6-tetramethyl-3,5-heptanedionate)627-500-7TETRAKIS(2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATO)ZIRCONIUMMFCD00145380TETRAKIS(2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATO)ZIRCONIUM(IV)I12088Zirconium tetrakis(2,2,6,6-tetramethyl-3,5-pimelate)Zirconium(III)tetrakis(2,2,6,6-tetramethyl-3,5-heptanedionate)Zirconium tetrakis(2,2,6,6-tetramethyl-3,5-heptanedionate), >=99.99%

データベース識別子

PubChem CID: 6287074

物性

構造計算による物性

極性表面積: 149 Å²
水素結合供与体数: 4
水素結合受容体数: 8
回転可能結合数: 12
重原子数: 53
形式電荷: 0
複雑度: 1,110