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Home > Encyclopedia > 2-[(PHENYLTHIO)METHYL]-2-CYCLOPENTEN-1-ONE

2-[(PHENYLTHIO)METHYL]-2-CYCLOPENTEN-1-ONE

2-[(PHENYLTHIO)METHYL]-2-CYCLOPENTEN-1-ONE structure

2-[(PHENYLTHIO)METHYL]-2-CYCLOPENTEN-1-ONE 

structure
  • CAS No:

    76047-52-4

  • Formula:

    C12H12OS

  • Chemical Name:

    2-[(PHENYLTHIO)METHYL]-2-CYCLOPENTEN-1-ONE

  • Synonyms:

    TIMTEC-BB SBB009972;2-[(PHENYLTHIO)METHYL]-2-CYCLOPENTEN-1-ONE;2-((PHENYLTHIO)METHYL)-2-CYCLOPENTEN- &;2-Cyclopenten-1-one, 2-[(phenylthio)methyl]-

2-[(PHENYLTHIO)METHYL]-2-CYCLOPENTEN-1-ONE Basic Attributes

204.29

204.06088618 g/mol

DTXSID40338450

Characteristics

42.37000

3.06800

1.17 g/mL at 25 °C(lit.)

145-150 °C0.8 mm Hg(lit.)

>230 °F

n20/D 1.6088(lit.)

Safety Information

UN 3334

3

Computed Properties

Molecular Weight:204.29
XLogP3:2.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:204.06088618
Monoisotopic Mass:204.06088618
Topological Polar Surface Area:42.4
Heavy Atom Count:14
Complexity:239
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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