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Home > Encyclopedia > 2-[5-CYANO-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ETHYL 4-METHYLBENZENESULFONATE

2-[5-CYANO-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ETHYL 4-METHYLBENZENESULFONATE

2-[5-CYANO-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ETHYL 4-METHYLBENZENESULFONATE structure

2-[5-CYANO-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ETHYL 4-METHYLBENZENESULFONATE 

structure
  • CAS No:

    106271-61-8

  • Formula:

    C14H13N3O5S

  • Chemical Name:

    2-[5-CYANO-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ETHYL 4-METHYLBENZENESULFONATE

  • Synonyms:

    2-[5-CYANO-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ETHYL 4-METHYLBENZENESULFONATE;2-(5-cyano-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)ethyl 4-methylbenzene-1-sulfonate

2-[5-CYANO-2,4-DIOXO-3,4-DIHYDRO-1(2H)-PYRIMIDINYL]ETHYL 4-METHYLBENZENESULFONATE Basic Attributes

335.34

335.058

Characteristics

125

0.5

238 - 240 °C (ethanol)

Computed Properties

Molecular Weight:335.34
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:335.05759170
Monoisotopic Mass:335.05759170
Topological Polar Surface Area:125
Heavy Atom Count:23
Complexity:662
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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