ethyl 2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate
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![ethyl 2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/d12274c7798b42bd8ba8b9b010ff9ed3.png "ethyl 2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate")
ethyl 2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate
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CAS No:
727982-12-9
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Formula:
C12H12BrN3O2S
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Chemical Name:
ethyl 2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate
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Synonyms:
ZINC6488507;AKOS001040599;MCULE-4755187835;SR-01000046686;SR-01000046686-1;Z25465841;ethyl 2-{[5-(4-bromophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetate;727982-12-9
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CAS No:
ethyl 2-[[5-(4-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetate Basic Attributes
342.21 g/mol
340.98336 g/mol
Computed Properties
Molecular Weight:342.21
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:340.98336
Monoisotopic Mass:340.98336
Topological Polar Surface Area:93.2
Heavy Atom Count:19
Complexity:301
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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