Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Hexanedioic acid, mixed esters with heptanoic acid and pentaerythritol
RN: 68937-27-9
InChIKey: NOKCKSWIXCXPJP-UHFFFAOYSA-N

Classification Code

  • TSCA UVCB

Molecular Formula

  • C7-H14-O2.C6-H10-O4.C5-H12-O4

Molecular Weight

  • 412.472
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • Hexanedioic acid, mixed esters with heptanoic acid and pentaerythritol

Registry Numbers

CAS Registry Number

  • 68937-27-9

System Generated Number

  • 0068937279

Molecular Formulas

Molecular Formula

  • C7-H14-O2.C6-H10-O4.C5-H12-O4

Molecular Formula Fragments

  • C5-H12-O4
  • C6-H10-O4
  • C7-H14-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C7H14O2.C6H10O4.C5H12O4/c1-2-3-4-5-6-7(8)9;7-5(8)3-1-2-4-6(9)10;6-1-5(2-7,3-8)4-9/h2-6H2,1H3,(H,8,9);1-4H2,(H,7,8)(H,9,10);6-9H,1-4H2

InChIKey

NOKCKSWIXCXPJP-UHFFFAOYSA-N

Smiles

OC(CCCCC(O)=O)=O.OC(=O)CCCCCC.OCC(CO)(CO)CO