MDL | MFCD12756428 |
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InChIKey | WGYAAUGIZMSWNE-UHFFFAOYSA-N |
Inchi | InChI=1S/C12H13BrClNO/c13-9-4-5-10(11(14)8-9)12(16)15-6-2-1-3-7-15/h4-5,8H,1-3,6-7H2 |
SMILES | C1CCN(CC1)C(=O)C2=C(C=C(C=C2)Br)Cl |
LogP | 3.66650 |
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PSA | 20.31000 |
精确分子量 | 300.98700 |
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氢键供体数量 | 0 |
氢键受体数量 | 2 |
可旋转化学键数量 | 2 |
重原子数量 | 16 |
海关编码 | 2933399090 |
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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% |
SMILES:BrC1=CC(Cl)=C(C=C1)C(=O)N2CCCCC2
ExSMILES:300.98699
InChI:
InChIKey:
IUPACName:
分子式:FormulaHtmlC12H13NOClBr