Chem
J-GLOBAL ID：200907031018187801
Nikkaji number：J1.050.146F
16-(1,4-Cyclopentadienyl)hexadecanoic acid
16-(1,4-シクロペンタジエニル)ヘキサデカン酸
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
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
Molecular formula： C21H36O2
Molecular formula furigana： C21-H36-O2
Molecular weight： 320.517
InChI：
InChI=1S/C21H36O2/c22-21(23)19-13-11-9-7-5-3-1-2-4-6-8-10-12-16-20-17-14-15-18-20/h14,17-18H,1-13,15-16,19H2,(H,22,23)
InChI key：
XGRGTXLADKHBSY-UHFFFAOYSA-N
SMILES：
OC(=O)CCCCCCCCCCCCCCCC1=CCC=C1
Systematic name (3)：
- 16-(1,4-シクロペンタジエニル)ヘキサデカン酸
- 16-(シクロペンタ-1,4-ジエン-1-イル)ヘキサデカン酸
- 16-(cyclopenta-1,4-dien-1-yl)hexadecanoic acid
- 16-(1,4-Cyclopentadienyl)hexadecanoic acid
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