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Substance Name: Ethylphenylpropiolate
RN: 2216-94-6
UNII: 09CYB3Z9MR
InChIKey: ACJOYTKWHPEIHW-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C11-H10-O2

Molecular Weight

  • 174.198
 
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Names and Synonyms

Name of Substance

  • Ethylphenylpropiolate

Synonyms

  • 4-09-00-02328 (Beilstein Handbook Reference)
  • AI3-04344
  • BRN 0639637
  • CCRIS 4504
  • EINECS 218-703-8
  • Ethyl 3-phenyl-2-propynoate
  • Ethyl 3-phenylpropiolate
  • Ethyl 3-phenylpropynoate
  • Ethyl phenylacetylenecarboxylate
  • Ethyl phenylpropiolate
  • Ethyl phenylpropriolate
  • Ethyl phenylpropynoate
  • NSC 41566
  • Phenylacetylene monocarboxylic acid ethyl ester
  • UNII-09CYB3Z9MR

Systematic Names

  • 2-Propynoic acid, 3-phenyl-, ethyl ester
  • 2-Propynoic acid, 3-phenyl-, ethyl ester (9CI)
  • Ethyl 3-phenylprop-2-ynoate
  • Ethyl phenylpropiolate
  • Propiolic acid, phenyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 2216-94-6

FDA UNII

  • 09CYB3Z9MR

System Generated Number

  • 0002216946

Structure Descriptors

InChI

1S/C11H10O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h3-7H,2H2,1H3

InChIKey

ACJOYTKWHPEIHW-UHFFFAOYSA-N

Smiles

c1(C#CC(=O)OCC)ccccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 265 deg C   EXP
log P (octanol-water) 2.350 (none)   EST
Atmospheric OH Rate Constant 1.21E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.