Molinate

CAS Registry Number®

2212-67-1
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CAS Name

Molinate

Molecular Formula

C9H17NOS

Molecular Mass

187.30

Cite this Page

Molinate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2212-67-1 (retrieved 2024-05-20) (CAS RN: 2212-67-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    136.5 °C @ Press: 10 Torr
  • Melting Point (2)

    <25 °C
  • Density (1)

    1.063 g/cm³ @ Temp: 20 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
  • (2) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C9H17NOS/c1-2-12-9(11)10-7-5-3-4-6-8-10/h2-8H2,1H3

InChIKey

InChIKey=DEDOPGXGGQYYMW-UHFFFAOYSA-N

SMILES

C(SCC)(=O)N1CCCCCC1

Canonical SMILES

O=C(SCC)N1CCCCCC1

Other Names for this Substance

  • 1H-Azepine-1-carbothioic acid, hexahydro-, S-ethyl ester
  • R 4572
  • S-Ethyl hexahydro-1H-azepine-1-carbothioate
  • Ethyl 1-hexamethyleneiminecarbothiolate
  • Hydram

Deleted or Replaced CAS Registry Numbers

71373-13-2

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