Methyl (2Z)-2-Cyano-3-(Ethylsulfanyl)-3-(Methylsulfanyl)Acrylate

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Properties Simple | Detailed

Formula C8H11NO2S2
IUPAC Name methyl (z)-2-cyano-3-ethylsulfanyl-3-methylsulfanyl-prop-2-enoate
Molecular Mass 217.308 g·mol−1
Heat of Formation -182.7 ± 16.7 kJ·mol−1
Dipole Moment 2.76 ± 1.08 D
Volume 255.7 Å 3
Surface Area 236.05 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy -1.38 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-2-cyano-3-(ethylthio)-3-(methylthio)acrylic acid methyl ester
  • (z)-2-cyano-3-(ethylthio)-3-(methylthio)prop-2-enoic acid methyl ester
  • 2-cyano-3-(ethylthio-3-methylthio)-2-propenoic acid methyl ester
  • 2-propenoic acid, 2-cyano-3-(ethylthio)-3-(methylthio)-, methyl ester
  • ay 28,200
  • ay 28200
  • methyl (z)-2-cyano-3-ethylsulfanyl-3-methylsulfanyl-prop-2-enoate
CAS Number(s)
  • 121635-47-0
InChIKey VQFTWIHXIAXAMC-VURMDHGXSA-N
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