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330839-25-3

330839-25-3 structural image
Product Name: [(1-CYCLOHEXYL-1H-TETRAAZOL-5-YL) SULFANYL]ACETIC ACID
Formula: C9H14N4O2S
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COMPUTED DESCRIPTORS

Molecular Weight 242.30 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 242.08374688 g/mol
Monoisotopic Mass 242.08374688 g/mol
Topological Polar Surface Area 106 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 248
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes