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Substance Name: Boric acid (H3BO3), trioctyl ester
RN: 2467-12-1
InChIKey: DTBRTYHFHGNZFX-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C24-H51-B-O3

Molecular Weight

  • 398.475
 
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Names and Synonyms

Synonyms

  • 4-01-00-01765 (Beilstein Handbook Reference)
  • AI3-51846
  • Boric acid, tri-n-octyl ester
  • BRN 1712338
  • EINECS 219-580-3
  • NSC 783
  • Octyl borate, (C8H17O)3 B
  • Tri-n-octyl borate
  • Trioctyl borate
  • Trioctyloxyborane

Systematic Names

  • Boric acid (H3BO3), trioctyl ester
  • Boric acid, tri-n-octyl ester
  • Trioctyl borate

Registry Numbers

CAS Registry Number

  • 2467-12-1

System Generated Number

  • 0002467121

Structure Descriptors

InChI

1S/C24H51BO3/c1-4-7-10-13-16-19-22-26-25(27-23-20-17-14-11-8-5-2)28-24-21-18-15-12-9-6-3/h4-24H2,1-3H3

InChIKey

DTBRTYHFHGNZFX-UHFFFAOYSA-N

Smiles

B(OCCCCCCCC)(OCCCCCCCC)OCCCCCCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1290mg/kg (1290mg/kg)   "Boron, Metallo-Boron Compounds and Boranes," Adams, R.M., ed., New York, John Wiley & Sons, Inc., 1964Vol. -, Pg. 693, 1964.