basic_info |
|
| Product_Name： | 3-BROMO-4-ETHYNYL-BENZOIC ACID METHYL ESTER |
| CAS： | 1204333-37-8 |
| EnglishSynonyms： | 3-BROMO-4-ETHYNYL-BENZOIC ACID METHYL ESTER ; METHYL 3-BROMO-4-ETHYNYLBENZOATE |
| pro_mdlNumber： | MFCD17012855 |
| pro_acceptors： | 2 |
| pro_donors： | 0 |
| pro_smile： | COC(=O)c1ccc(c(c1)Br)C#C |
| InChi： | InChI=1S/C10H7BrO2/c1-3-7-4-5-8(6-9(7)11)10(12)13-2/h1,4-6H,2H3 |
| InChiKey： | InChIKey=NPVLVLUVPFYCIR-UHFFFAOYSA-N |
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