3-bromo-5-(5-isopropyl-2-methylphenoxy)benzoic acid
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Basic information
GHS | |
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Exact Mass | 348.03611 |
Smiles | O=C(O)C1=CC(OC2=CC(C(C)C)=CC=C2C)=CC(Br)=C1 |
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Canonical Smiles | CC1=CC=C(C=C1OC1C=C(C=C(Br)C=1)C(O)=O)C(C)C |
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Inchi | InChI=1S/C17H17BrO3/c1-10(2)12-5-4-11(3)16(8-12)21-15-7-13(17(19)20)6-14(18)9-15/h4-10H,1-3H3,(H,19,20) |
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InchiKey | MECZGMJLXXDJLJ-UHFFFAOYSA-N |
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Security information
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