Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzoic acid, 4-(octyloxy)-, 4-(2-methylbutyl)phenyl ester
RN: 84236-44-2
InChIKey: XSEXHHROOVDZBQ-UHFFFAOYSA-N

Classification Code

  • TSCA Flag P (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C26-H36-O3

Molecular Weight

  • 396.567
 
* 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

Synonym

  • EINECS 282-476-1

Systematic Names

  • 4-(2-Methylbutyl)phenyl (1)-4-octyloxybenzoate
  • Benzoic acid, 4-(octyloxy)-, 4-(2-methylbutyl)phenyl ester

Registry Numbers

CAS Registry Number

  • 84236-44-2

Other Registry Number

  • 100545-63-9

System Generated Number

  • 0084236442

Structure Descriptors

InChI

1S/C26H36O3/c1-4-6-7-8-9-10-19-28-24-17-13-23(14-18-24)26(27)29-25-15-11-22(12-16-25)20-21(3)5-2/h11-18,21H,4-10,19-20H2,1-3H3

InChIKey

XSEXHHROOVDZBQ-UHFFFAOYSA-N

Smiles

C(c1ccc(cc1)OCCCCCCCC)(=O)Oc1ccc(cc1)C[C@@H](CC)C