MDL | MFCD01194284 |
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InChIKey | HCJMNOSIAGSZBM-UHFFFAOYSA-N |
Inchi | 1S/C8H8O3/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4,9H,1H3,(H,10,11) |
SMILES | OC1=CC=CC(C)=C1C(=O)O |
BRN | 2208693 |
LogP | 1.39880 |
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PSA | 57.53000 |
沸點(diǎn) | 300.4°C at 760 mmHg |
熔點(diǎn) | 170-173°C |
精確分子量 | 152.04700 |
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氫鍵供體數量 | 2 |
氫鍵受體數量 | 3 |
可旋轉化學(xué)鍵數量 | 1 |
重原子數量 | 11 |
復雜度 | 155 |
疏水參數計算參考值(XlogP) | 1.9 |
拓撲分子極性表面積 | 57.5 |
EINECS | 403256 |
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海關(guān)編碼 | 2918290000 |
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海關(guān)數據 | 中國海關(guān)編碼:2918290000概述:2918290000 其他含酚基但不含其他含氧基羧酸及其酸酐、酰鹵化物、過(guò)氧化物和過(guò)氧酸及它們的衍生物。監管條件:AB(入境貨物通關(guān)單,出境貨物通關(guān)單)。增值稅率:17.0%。退稅率:9.0%。最惠國關(guān)稅:6.5%。普通關(guān)稅:30.0% 申報要素:品名, 成分含量, 用途 監管條件:A.入境貨物通關(guān)單 檢驗檢疫類(lèi)別:R.進(jìn)口食品衛生監督檢驗 Summary:HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0% |
PubChemId | 11279 |
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SMILES
OC(=O)C1C(O)=CC=CC=1C