Chem
J-GLOBAL ID：201907000881048920
Nikkaji number：J3.739.123I
diethyl difluoro[1-hydroxy-2-isopropoxy-4-oxo-3-(2-phenylethynyl)cyclobut-2-en-1-yl]methylphosphonate
ジエチルジフルオロ[1-ヒドロキシ-2-イソプロポキシ-4-オキソ-3-(2-フェニルエチニル)シクロブタ-2-エン-1-イル]メチルホスホナート
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： C20H23F2O6P
Molecular formula furigana： C20-H23-F2-O6-P
Molecular weight： 428.369
InChI：
InChI=1S/C20H23F2O6P/c1-5-26-29(25,27-6-2)20(21,22)19(24)17(23)16(18(19)28-14(3)4)13-12-15-10-8-7-9-11-15/h7-11,14,24H,5-6H2,1-4H3
InChI key：
XBVSJHDUJHTSGE-UHFFFAOYSA-N
SMILES：
C1(=O)C(=C(C1(C(F)(F)P(=O)(OCC)OCC)O)OC(C)C)C#Cc1ccccc1
Systematic name (3)：
- 2-(フェニルエチニル)-3-イソプロポキシ-4-ヒドロキシ-4-[(ジエトキシホスフィニル)ジフルオロメチル]-2-シクロブテン-1-オン
- ジエチル{ジフルオロ[1-ヒドロキシ-4-オキソ-3-(2-フェニルエチニル)-2-(プロパン-2-イルオキシ)シクロブタ-2-エン-1-イル]メチル}ホスホナート
- diethyl {difluoro[1-hydroxy-4-oxo-3-(2-phenylethynyl)-2-(propan-2-yloxy)cyclobut-2-en-1-yl]methyl}phosphonate
- ジエチルジフルオロ[1-ヒドロキシ-2-イソプロポキシ-4-オキソ-3-(2-フェニルエチニル)シクロブタ-2-エン-1-イル]メチルホスホナート
- diethyl difluoro[1-hydroxy-2-isopropoxy-4-oxo-3-(2-phenylethynyl)cyclobut-2-en-1-yl]methylphosphonate
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