13042-55-2 （1,5-二脱氧-1,5-亚氨基木糖醇,Piperidine-3,4,5-triol）
中文名称： 1,5-二脱氧-1,5-亚氨基木糖醇
英文名称： Piperidine-3,4,5-triol
CAS No.： 13042-55-2
分子式： C5 H1 1 NO3
分子量： 133.14574
名称和标识符 InChIKey RMCNETIHECSPMZ-UHFFFAOYSA-N Inchi InChI=1S/C5H11NO3/c7-3-1-6-2-4(8)5(3)9/h3-9H,1-2H2 SMILES N1CC(O)C(O)C(O)C1
别名信息
- 英文别名 - Piperidine-3,4,5-triol 1,5-DIDEOXY-1,5-IMINO-XYLITOL 3,4,5-Piperidinetriol,(3a,4b,5a)- 1,5-dideoxy-1,5-imino-D-xylitol 1,5-dideoxy-1,5-iminoxylitol 3,4,5-trans,trans-Trihydroxypiperidine 3,4,5-trihydroxypiperidin EN300-717692 13042-55-2 FT-0690906 PD179204 SCHEMBL24518480 SCHEMBL350302 PIPERIDINE-3,4,5-TRIOL SB42853 CID 3400852 704864-61-9
物化性质
实验特性 LogP -1.99890 PSA 72.72000 折射率 1.582 沸点 282.6°Cat760mmHg 闪点 161.3°C 密度 1.424
计算特性 精确分子量 133.07400 氢键供体数量 4 氢键受体数量 4 可旋转化学键数量 0 同位素质量 133.074 重原子数量 9 复杂度 88.2 同位素原子数量 0 确定原子立构中心数量 0 不确定原子立构中心数量 2 确定化学键立构中心数量 0 不确定化学键立构中心数量 0 共价键单元数量 1 疏水参数计算参考值（XlogP） -2.3 拓扑分子极性表面积 72.7Ų
海关数据 海关编码 2933399090 海关数据
中国海关编码： 2933399090
概述： 2933399090. 其他结构含非稠合吡啶环的化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素： 品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期
Summary： 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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