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Home > Encyclopedia > 3,3-BIS-METHYLSULFANYL-1-(4-NITRO-PHENYL)-PROPENONE

3,3-BIS-METHYLSULFANYL-1-(4-NITRO-PHENYL)-PROPENONE

3,3-BIS-METHYLSULFANYL-1-(4-NITRO-PHENYL)-PROPENONE structure

3,3-BIS-METHYLSULFANYL-1-(4-NITRO-PHENYL)-PROPENONE 

structure
  • CAS No:

    81375-97-5

  • Formula:

    C11H12NO3S2

  • Chemical Name:

    3,3-BIS-METHYLSULFANYL-1-(4-NITRO-PHENYL)-PROPENONE

  • Synonyms:

    3,3-bis(methylsulfanyl)-1-(4-nitrophenyl)prop-2-en-1-one;3,3-BIS-METHYLSULFANYL-1-(4-NITRO-PHENYL)-PROPENONE;CHEMBL241632;SCHEMBL21253256;CTK5E8742;DTXSID90409063;ZINC227148;4-Nitrobenzoylketene dimethyl dithioacetal;FT-0703680;3,3-bis(methylthio)-1-(4-nitrophenyl)prop-2-en-1-one

3,3-BIS-METHYLSULFANYL-1-(4-NITRO-PHENYL)-PROPENONE Basic Attributes

269.34000

269.01800

DTXSID90409063

Characteristics

113.49000

3.86810

1.322g/cm3

429.8ºC at 760 mmHg

213.7ºC

1.631

Computed Properties

Molecular Weight:269.3
XLogP3:2.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:269.01803556
Monoisotopic Mass:269.01803556
Topological Polar Surface Area:114
Heavy Atom Count:17
Complexity:311
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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