Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Heptanoic acid, ester with 2,2-bis(hydroxymethyl)-1,3-propanediol
RN: 11138-45-7
InChIKey: MKTTVBSRYXIYCV-UHFFFAOYSA-N

Molecular Formula

  • C7-H14-O2.x-C5-H12-O4

Molecular Weight

  • 266.331
 
* 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

  • EINECS 234-389-5
  • Heptanoic acid, pentaerythritol ester
  • Pentaerythritol heptanoate

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 11138-45-7

System Generated Number

  • 0011138457

Molecular Formulas

Molecular Formula

  • C7-H14-O2.x-C5-H12-O4

Molecular Formula Fragments

  • C5-H12-O4
  • C7-H14-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C7H14O2.C5H12O4/c1-2-3-4-5-6-7(8)9;6-1-5(2-7,3-8)4-9/h2-6H2,1H3,(H,8,9);6-9H,1-4H2

InChIKey

MKTTVBSRYXIYCV-UHFFFAOYSA-N

Smiles

CCCCCCC(=O)O.C(C(CO)(CO)CO)O