Chem
J-GLOBAL ID：201207070124582290   Nikkaji number：J3.005.088F

Pivalic acid 1-phenyl-1-isobutyl-3-methylbutyl ester

ピバル酸1-フェニル-1-イソブチル-3-メチルブチル
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： C20H32O2
Molecular formula furigana： C20-H32-O2
Molecular weight： 304.474
InChI： InChI=1S/C20H32O2/c1-15(2)13-20(14-16(3)4,17-11-9-8-10-12-17)22-18(21)19(5,6)7/h8-12,15-16H,13-14H2,1-7H3
InChI key： LNDSIXDLNUMGAT-UHFFFAOYSA-N
SMILES： CC(C)CC(CC(C)C)(OC(=O)C(C)(C)C)c1ccccc1
Systematic name  (4)：
  • 2,2-ジメチルプロパン酸2,6-ジメチル-4-フェニルヘプタン-4-イル
  • ピバル酸1-フェニル-1-イソブチル-3-メチルブチル
  • 2,6-ジメチル-4-フェニルヘプタン-4-イル 2,2-ジメチルプロパノアート
  • 2,6-dimethyl-4-phenylheptan-4-yl 2,2-dimethylpropanoate
Other name (2)：
  • 2,2-Dimethylpropanoic acid 2,6-dimethyl-4-phenylheptane-4-yl ester
  • Pivalic acid 1-phenyl-1-isobutyl-3-methylbutyl ester
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