Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Heptanoic acid, ester with 2-ethyl-2-(hydroxymethyl)-1,3-propanediol
RN: 68855-17-4
InChIKey: SHXZNGNFRDVQCD-UHFFFAOYSA-N

Molecular Formula

  • C7-H14-O2.x-C6-H14-O3

Molecular Weight

  • 264.359
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • Heptanoic acid, trimethylolpropane ester
  • Trimethylolpropane heptanoate

Systematic Name

  • Heptanoic acid, ester with 2-ethyl-2-(hydroxymethyl)-1,3-propanediol

Registry Numbers

CAS Registry Number

  • 68855-17-4

Other Registry Number

  • 191807-43-9

System Generated Number

  • 0068855174

Molecular Formulas

Molecular Formula

  • C7-H14-O2.x-C6-H14-O3

Molecular Formula Fragments

  • C6-H14-O3
  • C7-H14-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C7H14O2.C6H14O3/c1-2-3-4-5-6-7(8)9;1-2-6(3-7,4-8)5-9/h2-6H2,1H3,(H,8,9);7-9H,2-5H2,1H3

InChIKey

SHXZNGNFRDVQCD-UHFFFAOYSA-N

Smiles

O=C(O)CCCCCC.C(C(CO)(CO)CC)O