2-[(5-Cyclohexyl-4-ethyl-4H-1,2,4-triazol-3-yl)thio]acetic acid
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2-[(5-Cyclohexyl-4-ethyl-4H-1,2,4-triazol-3-yl)thio]acetic acid
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CAS No:
462066-83-7
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Formula:
C12H19N3O2S
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Chemical Name:
2-[(5-Cyclohexyl-4-ethyl-4H-1,2,4-triazol-3-yl)thio]acetic acid
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Synonyms:
Acetic acid,2-[(5-cyclohexyl-4-ethyl-4H-1,2,4-triazol-3-yl)thio]-;Acetic acid,[(5-cyclohexyl-4-ethyl-4H-1,2,4-triazol-3-yl)thio]-;2-[(5-Cyclohexyl-4-ethyl-4H-1,2,4-triazol-3-yl)thio]acetic acid;(5-Cyclohexyl-4-ethyl-4H-[1,2,4]triazol-3-yl-sulfanyl)acetic acid;(5-Cyclohexyl-4-ethyl-4H-[1,2,4]triazol-3-ylsulfanyl)-acetic acid;2-[(5-Cyclohexyl-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid
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CAS No:
2-[(5-Cyclohexyl-4-ethyl-4H-1,2,4-triazol-3-yl)thio]acetic acid Basic Attributes
269.36
269.36
DTXSID00349507
2933990090
Computed Properties
Molecular Weight:269.37
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:269.11979803
Monoisotopic Mass:269.11979803
Topological Polar Surface Area:93.3
Heavy Atom Count:18
Complexity:285
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-[(5-Cyclohexyl-4-ethyl-4H-1,2,4-triazol-3-yl)thio]acetic acid
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