化工社化工社 化学情報印刷レポート · 研究参考用
HCID 159190332作成日:2026年10月30日
sodium;6-chloro-5-[2-(3,4-difluorophenyl)acetyl]-7-sulfinatochloranuidyl-2,3-dihydro-1H-pyrrolizine;2-chloro-3-[2-(3,4-difluorophenyl)acetyl]-N-(1,1,1-trifluoropropan-2-yl)-6,7-dihydro-5H-pyrrolizine-1-sulfonamide;bis(1-(2-chloro-6,7-dihydro-5H-pyrrolizin-3-yl)-2-(3,4-difluorophenyl)ethanone);deuteriomethanethiol;3,4-difluoroaniline;ethyl 2-chloro-6,7-dihydro-5H-pyrrolizine-3-carboxylate;ethyl 2-chloro-5H-indolizine-3-carboxylate;ethyl 2-chloro-5H-pyrrolizine-3-carboxylate;hydride;methane;sulfurochloridic acid;sulfur trioxide;thionyl dichloride;1,1,1-trifluoropropan-2-amine
https://huagongshe.com/ja/chemical/159190332
![sodium;6-chloro-5-[2-(3,4-difluorophenyl)acetyl]-7-sulfinatochloranuidyl-2,3-dihydro-1H-pyrrolizine;2-chloro-3-[2-(3,4-difluorophenyl)acetyl]-N-(1,1,1-trifluoropropan-2-yl)-6,7-dihydro-5H-pyrrolizine-1-sulfonamide;bis(1-(2-chloro-6,7-dihydro-5H-pyrrolizin-3-yl)-2-(3,4-difluorophenyl)ethanone);deuteriomethanethiol;3,4-difluoroaniline;ethyl 2-chloro-6,7-dihydro-5H-pyrrolizine-3-carboxylate;ethyl 2-chloro-5H-indolizine-3-carboxylate;ethyl 2-chloro-5H-pyrrolizine-3-carboxylate;hydride;methane;sulfurochloridic acid;sulfur trioxide;thionyl dichloride;1,1,1-trifluoropropan-2-amine の分子構造式](/img/chemical/159190332.png)
識別子と物理属性
| 分子式 | C107H112Cl11F16N10NaO21S6-2 |
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| 平均分子量 | 2,784.4 g/mol |
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| SMILES | [H-].[2H]CS.C.C.C.CCOC(=O)C1=C(C=C2N1CCC2)Cl.CCOC(=O)C1=C(C=C2N1CC=C2)Cl.CCOC(=O)C1=C(C=C2N1CC=C=C2)Cl.CC(C(F)(F)F)N.CC(C(F)(F)F)NS(=O)(=O)C1=C2CCCN2C(=C1Cl)C(=O)CC3=CC(=C(C=C3)F)F.C1CC2=CC(=C(N2C1)C(=O)CC3=CC(=C(C=C3)F)F)Cl.C1CC2=CC(=C(N2C1)C(=O)CC3=CC(=C(C=C3)F)F)Cl.C1CC2=C(C(=C(N2C1)C(=O)CC3=CC(=C(C=C3)F)F)Cl)[Cl-]S(=O)[O-].C1=CC(=C(C=C1N)F)F.OS(=O)(=O)Cl.O=S(=O)=O.O=S(Cl)Cl.[Na+] |
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| InChIKey | PDIQKHISORLHIJ-BTLNWKSBSA-M |
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| PubChem CID | 159190332 |
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化学・物理的性質
| 極性表面積 | 500 |
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| 水素結合供与体数 | 5 |
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| 水素結合受容体数 | 45 |
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| 回転可能結合数 | 25 |
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| 重原子数 | 172 |
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| 形式電荷 | -2 |
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| 複雑度 | 2,800 |
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