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API
Weight187.308 g/mol
FormulaC9H17NOS
Hydrogen Acceptors2
Hydrogen Donors0
Aromatic Rings0
Rotatable Bonds1

MOLINATE (2212-67-1)

Jalan  ·  Ordram  ·  hexahydro-1H-azepine-1-carbothioic acid S-ethyl ester

Score: #137 in Environmental science , #153 in Microbiology , #1603 in Biology , #1887 in Chemistry
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Areas of Application

Safety

  • H302: Harmful if swallowed
    Warning Acute toxicity, oral - Category 4
  • H316: Causes mild skin irritation
    Warning Skin corrosion/irritation - Category 3
  • H332: Harmful if inhaled
    Warning Acute toxicity, inhalation - Category 4
  • H361: Suspected of damaging fertility or the unborn child
    Warning Reproductive toxicity - Category 2
  • H400: Very toxic to aquatic life
    Warning Hazardous to the aquatic environment, acute hazard - Category 1
  • H410: Very toxic to aquatic life with long lasting effects
    Warning Hazardous to the aquatic environment, long-term hazard - Category 1

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Alternate Names

  • Jalan
  • Ordram
  • hexahydro-1H-azepine-1-carbothioic acid S-ethyl ester
  • S-ethyl 1-hexamethylenamino-thiocarbamate
  • S-ethyl 1-hexamethylenaminothiocarbamate
  • Ialan
  • SMILES
    CCSC(=O)N1CCCCCC1
  • InChIKey
    DEDOPGXGGQYYMW-UHFFFAOYSA-N

External Links

Synthesis

Ethyl chlorothioformate  +  Hexamethyleneimine (Schotten-Baumann amide from acid)
Synthesis of MOLINATE ›

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