Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Dodecanoic acid, mixed esters with 2-ethylhexanoic acid, 2,2,4-trimethyl-1,3-pentanediol and valeric acid
RN: 70693-36-6
InChIKey: HHIKYOKGZSHMCT-DEOSSOPVSA-N

Classification Code

  • TSCA UVCB

Molecular Formula

  • C12-H24-O2.C8-H18-O2.C8-H16-O2.C5-H10-O2

Molecular Weight

  • 412.6502
 
* 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

  • Dodecanoic acid, mixed esters with 2-ethylhexanoic acid, 2,2,4-trimethyl-1,3-pentanediol and valeric acid

Registry Numbers

CAS Registry Number

  • 70693-36-6

System Generated Number

  • 0070693366

Molecular Formulas

Molecular Formula

  • C12-H24-O2.C8-H18-O2.C8-H16-O2.C5-H10-O2

Molecular Formula Fragments

  • C12-H24-O2
  • C5-H10-O2
  • C8-H16-O2
  • C8-H18-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C25H48O4/c1-7-9-11-12-13-14-15-16-17-19-22(26)28-20-25(5,6)24(21(3)4)29-23(27)18-10-8-2/h21,24H,7-20H2,1-6H3/t24-/m0/s1

InChIKey

HHIKYOKGZSHMCT-DEOSSOPVSA-N

Smiles

CCCCCCCCCCCC(=O)OCC(C)(C)[C@H](C(C)C)OC(=O)CCCC