26394-17-2

• 常用中文名：环戊烷磺酰氯
• 常用英文名：Cyclopentanesulfonyl Chloride
• CAS号：26394-17-2
• 分子式：C₅H₉ClO₂S
• 分子量：168.64200
• 相关类别： 有机原料 羧酸类化合物及衍生物 羧酸酰卤化物
• 发布时间：2018-03-02 08:00:00
• 更新时间：2024-01-09 14:56:47
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名称

• 中文名: 环戊烷磺酰氯
• 英文名: cyclopentanesulfonyl chloride
• 中文别名: 环戊基磺酰氯
• 英文别名: Cyclopentanesulphonyl chloride; 4-cyclopentylsulfonylchloride; chlorocyclopentylsulfone; Cyclopentansulfochlorid; Cyclopentansulfonylchlorid; Cyclopentanesulfonyl chloride; Cyclopentanesulfonylchloride; Cyclopentylsulfonyl chloride

物化性质

• 密度: 1.279 g/mL at 25ºC
• 沸点: 99ºC/7mm
• 分子式: C₅H₉ClO₂S
• 分子量: 168.64200
• 闪点: >230 °F
• 精确质量: 168.00100
• PSA: 42.52000
• LogP: 2.57840
• 外观性状: Liquid | Pale to dark brown
• 蒸汽压: 0.0718mmHg at 25°C
• 折射率: n20/D 1.4918
• 储存条件: 室温，干燥
• 计算化学:

  1.疏水参数计算参考值（XlogP）:1.7

  2.氢键供体数量:0

  3.氢键受体数量:2

  4.可旋转化学键数量:1

  5.互变异构体数量:无

  6.拓扑分子极性表面积:42.5

  7.重原子数量:9

  8.表面电荷:0

  9.复杂度:174

  10.同位素原子数量:0

  11.确定原子立构中心数量:0

  12.不确定原子立构中心数量:0

  13.确定化学键立构中心数量:0

  14.不确定化学键立构中心数量:0

  15.共价键单元数量:1

安全

• 符号: GHS05
• 信号词: Danger
• 危害声明: H314
• 警示性声明: P280-P305 + P351 + P338-P310
• 个人防护装备: Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
• 危害码 (欧洲): C,Xi
• 风险声明 (欧洲): 34
• 安全声明 (欧洲): 26-36/37/39-45
• 危险品运输编码: UN 3265 8/PG 2
• WGK德国: 3
• 海关编码: 2904909090

合成路线

32916-51-1 ~% 26394-17-2

文献：Bristol-Myers Squibb Company Patent: US2008/107623 A1, 2008 ; Location in patent: Page/Page column 30 ;

7791-25-5 32916-51-1 ~% 26394-17-2

文献：Bristol-Myers Squibb Company Patent: US2007/99825 A1, 2007 ; Location in patent: Page/Page column 34 ;

137-43-9 ~% 26394-17-2

文献：Hirsch, Anna K. H.; Alphey, Magnus S.; Lauw, Susan; Seet, Michael; Barandun, Luzi; Eisenreich, Wolfgang; Rohdich, Felix; Hunter, William N.; Bacher, Adelbert; Diederich, Francois Organic and Biomolecular Chemistry, 2008 , vol. 6, # 15 p. 2719 - 2730

19247-73-5 ~% 26394-17-2

文献：De Dios, Alfonso; Shih, Chuan; Lopez De Uralde, Beatriz; Sanchez, Concepcion; Del Prado, Miriam; Martin Cabrejas, Luisa M.; Pleite, Sehila; Blanco-Urgoiti, Jaime; Lorite, Maria Jose; Nevill Jr., C. Richard; Bonjouklian, Rosanne; York, Jeremy; Vieth, Michal; Wang, Yong; Magnus, Nicholas; Campbell, Robert M.; Anderson, Bryan D.; McCann, Denis J.; Giera, Deborah D.; Lee, Paul A.; Schultz, Richard M.; Li, Li C.; Johnson, Lea M.; Wolos, Jeffrey A. Journal of Medicinal Chemistry, 2005 , vol. 48, # 7 p. 2270 - 2273

1679-07-8 ~% 26394-17-2

文献：De Dios, Alfonso; Shih, Chuan; Lopez De Uralde, Beatriz; Sanchez, Concepcion; Del Prado, Miriam; Martin Cabrejas, Luisa M.; Pleite, Sehila; Blanco-Urgoiti, Jaime; Lorite, Maria Jose; Nevill Jr., C. Richard; Bonjouklian, Rosanne; York, Jeremy; Vieth, Michal; Wang, Yong; Magnus, Nicholas; Campbell, Robert M.; Anderson, Bryan D.; McCann, Denis J.; Giera, Deborah D.; Lee, Paul A.; Schultz, Richard M.; Li, Li C.; Johnson, Lea M.; Wolos, Jeffrey A. Journal of Medicinal Chemistry, 2005 , vol. 48, # 7 p. 2270 - 2273

287-92-3 ~% 26394-17-2

文献：Truce; Milionis Journal of Organic Chemistry, 1952 , vol. 17, p. 1529,1532

96-41-3 ~% 26394-17-2

文献：Aristarkhova,L.N. et al. Journal of Organic Chemistry USSR (English Translation), 1970 , vol. 6, p. 2454 - 2458 Zhurnal Organicheskoi Khimii, 1970 , vol. 6, # 12 p. 2442 - 2446

海关

海关编码	2904909090
中文概述	2904909090 其他烃的磺化、硝化、亚硝化衍生物（不论是否卤化）. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0%
申报要素	品名, 成分含量, 用途
Summary	HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%