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熔点:
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121-122 °C
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沸点:
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395.6±22.0 °C(Predicted)
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密度:
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1.247±0.06 g/cm3(Predicted)
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酸度系数(pKa):
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3.53±0.25(Predicted)
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InChI:
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InChI=1/C13H16O3/c14-12(15)13(16,11-8-4-5-9-11)10-6-2-1-3-7-10/h1-3,6-7,11,16H,4-5,8-9H2,(H,14,15)/t13-/s3
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InChIKey:
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WFLUEQCOAQCQLP-VHLFKADZNA-N
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SMILES:
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[C@](C1CCCC1)(C1C=CC=CC=1)(O)C(=O)O |&1:0,r|
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