Propanoic acid, 3-isocyanato-, ethyl ester

CAS Registry Number®

5100-34-5
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CAS Name

Propanoic acid, 3-isocyanato-, ethyl ester

Molecular Formula

C6H9NO3

Molecular Mass

143.14

Cite this Page

Propanoic acid, 3-isocyanato-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5100-34-5 (retrieved 2024-04-20) (CAS RN: 5100-34-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    94-95 °C @ Press: 20 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H9NO3/c1-2-10-6(9)3-4-7-5-8/h2-4H2,1H3

InChIKey

InChIKey=XBSGYVHOINMTIM-UHFFFAOYSA-N

SMILES

C(C(OCC)=O)CN=C=O

Canonical SMILES

O=C=NCCC(=O)OCC

Other Names for this Substance

  • Propanoic acid, 3-isocyanato-, ethyl ester
  • Propionic acid, 3-isocyanato-, ethyl ester
  • Ethyl 3-isocyanatopropanoate
  • Ethyl 3-isocyanatopropionate
  • 3-Isocyanatopropanoic acid ethyl ester

Deleted or Replaced CAS Registry Numbers

1025436-15-0

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