Chem
J-GLOBAL ID：201907008953673035
Nikkaji number：J3.741.084E
(1Z)-1-(4-ヨードフェニル)-3-オキソ-3-(3,4,5-トリメトキシフェニル)プロパ-1-エン-1-イルジフルオロボリナート
(1Z)-1-(4-ヨードフェニル)-3-オキソ-3-(3,4,5-トリメトキシフェニル)プロパ-1-エン-1-イルジフルオロボリナート
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： C18H16BF2IO5
Molecular formula furigana： C18-H16-B-F2-I-O5
Molecular weight： 488.030
InChI：
InChI=1S/C18H16BF2IO5/c1-24-16-8-12(9-17(25-2)18(16)26-3)14(23)10-15(27-19(20)21)11-4-6-13(22)7-5-11/h4-10H,1-3H3/b15-10-
InChI key：
KIBBYMYBHIDYQD-GDNBJRDFSA-N
SMILES：
C(=O)(/C=C(/c1ccc(cc1)I)\OB(F)F)c1cc(c(c(c1)OC)OC)OC
Systematic name (3)：
- (Z)-1-(3,4,5-トリメトキシフェニル)-3-[(ジフルオロボリル)オキシ]-3-(4-ヨードフェニル)-2-プロペン-1-オン
- (1Z)-1-(4-ヨードフェニル)-3-オキソ-3-(3,4,5-トリメトキシフェニル)プロパ-1-エン-1-イルジフルオロボリナート
- (1Z)-1-(4-iodophenyl)-3-oxo-3-(3,4,5-trimethoxyphenyl)prop-1-en-1-yl difluoroborinate
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