5-methyl-3-[(4-pentoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole
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![5-methyl-3-[(4-pentoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/93da0cadb3ba4ba79641f59ede8daa9a.png "5-methyl-3-[(4-pentoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole")
5-methyl-3-[(4-pentoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole
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CAS No:
57736-56-8
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Formula:
C15H21N3OS
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Chemical Name:
5-methyl-3-[(4-pentoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole
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Synonyms:
5-methyl-3-[(4-pentoxyphenyl)methylthio]-1H-1,2,4-triazole;MLS000717149;CHEMBL1468819;CHEBI:112198;HMS2655M07;5-methyl-3-[(4-pentoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole;ZINC5735296;STK998388;AKOS000505316;MCULE-2864120215;SMR000278516;Q27192300;3-methyl-5-{[4-(pentyloxy)benzyl]sulfanyl}-4H-1,2,4-triazole;57736-56-8
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CAS No:
5-methyl-3-[(4-pentoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Basic Attributes
291.4 g/mol
291.14053348 g/mol
Computed Properties
Molecular Weight:291.4
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:291.14053348
Monoisotopic Mass:291.14053348
Topological Polar Surface Area:76.1
Heavy Atom Count:20
Complexity:260
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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