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1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one

1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one structure

CAS No:
181934-31-6
Formula:
C15H9IO2
Chemical Name:
1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one
Synonyms:
1,2-Benziodoxol-3(1H)-one,1-(2-phenylethynyl)-;1,2-Benziodoxol-3(1H)-one,1-(phenylethynyl)-;1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one;NSC 692392;1-(Phenylethynyl)-1λ3-Benzo[d][1,2]iodaoxol-3(1H)-one;EBX-Ph

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1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one Basic Attributes

Molecular Weight：

348.13 g/mol

Exact Mass：

348.14

NSC Number：

692392

Characteristics

PSA：

26.3 Å²

Melting Point：

147-156 °C (decomp)

Computed Properties

Molecular Weight:348.13
XLogP3:4.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:347.96473
Monoisotopic Mass:347.96473
Topological Polar Surface Area:26.3
Heavy Atom Count:18
Complexity:386
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(2-Phenylethynyl)-1,2-benziodoxol-3(1H)-one

Basic Attributes
Characteristics
Computed Properties

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