MDL | MFCD11617260 |
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InChIKey | CVKDGGIRBCXOSZ-UHFFFAOYSA-N |
Inchi | InChI=1S/C7H7BClFO3/c1-13-5-3-2-4(9)6(7(5)10)8(11)12/h2-3,11-12H,1H3 |
SMILES | COC1=C(C(=C(C=C1)Cl)B(O)O)F |
LogP | 0.16750 |
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PSA | 49.69000 |
精确分子量 | 204.01600 |
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氢键供体数量 | 2 |
氢键受体数量 | 3 |
可旋转化学键数量 | 2 |
重原子数量 | 13 |
HazardClass | IRRITANT |
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海关编码 | 2931900090 |
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海关数据 |
中国海关编码:2931900090概述:2931900090. 其他有机-无机化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:AB(入境货物通关单,出境货物通关单). 最惠国关税:6.5%. 普通关税:30.0% Summary:2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0% |
SMILES:COC1=C(F)C(B(O)O)=C(Cl)C=C1
ExSMILES:204.01611
InChI:
InChIKey:
IUPACName:
分子式:FormulaHtmlC7H7BO3FCl