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Home > Encyclopedia > 4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 3-nitrobenzoate

4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 3-nitrobenzoate

4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 3-nitrobenzoate structure

4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 3-nitrobenzoate 

structure
  • CAS No:

    669716-01-2

  • Formula:

    C18H12N2O5S

  • Chemical Name:

    4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 3-nitrobenzoate

  • Synonyms:

    4-(1,3-benzoxazol-2-ylsulfanyl)but-2-yn-1-yl 3-nitrobenzoate;ZINC2195036;STK177487;AKOS003310141;MCULE-5961375444;669716-01-2

4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 3-nitrobenzoate Basic Attributes

368.4 g/mol

368.04669266 g/mol

Characteristics

123 Ų

Computed Properties

Molecular Weight:368.4
XLogP3:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:368.04669266
Monoisotopic Mass:368.04669266
Topological Polar Surface Area:123
Heavy Atom Count:26
Complexity:581
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 3-nitrobenzoate

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