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Substance Name: Boric acid, triisobutyl ester
RN: 13195-76-1
InChIKey: LHJSLDBKUGXPMI-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C12-H27-B-O3

Molecular Weight

  • 230.153
 
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Names and Synonyms

Synonyms

  • 4-01-00-01602 (Beilstein Handbook Reference)
  • AI3-09515
  • Boric acid, triisobutyl ester
  • BRN 1703849
  • EINECS 236-160-5
  • NSC 65329
  • Triisobutyl borate

Systematic Names

  • Boric acid (H3BO3), triisobutyl ester (8CI)
  • Boric acid (H3BO3), tris(2-methylpropyl) ester (9CI)
  • Boric acid, triisobutyl ester
  • Triisobutyl borate

Superlist Names

  • Boric acid, tris(2-methylpropyl) ester
  • Triisobutyl borate

Registry Numbers

CAS Registry Number

  • 13195-76-1

System Generated Number

  • 0013195761

Structure Descriptors

InChI

1S/C12H27BO3/c1-10(2)7-14-13(15-8-11(3)4)16-9-12(5)6/h10-12H,7-9H2,1-6H3

InChIKey

LHJSLDBKUGXPMI-UHFFFAOYSA-N

Smiles

B(OCC(C)C)(OCC(C)C)OCC(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2400mg/kg (2400mg/kg)   "Boron, Metallo-Boron Compounds and Boranes," Adams, R.M., ed., New York, John Wiley & Sons, Inc., 1964Vol. -, Pg. 693, 1964.