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Substance Name: Trihexylene glycol diborate
RN: 100-89-0
InChIKey: QXMQBCRKITYLGR-UHFFFAOYSA-N

Molecular Formula

  • C18-H36-B2-O6

Molecular Weight

  • 370.098
 
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Names and Synonyms

Results Name

  • Trihexylene glycol diborate

Synonyms

  • 1,3,2-Dioxaborinane, 2,2'-((1,1,3-trimethyl-1,3-propanediyl)bis(oxy))bis(4,4,6-trimethyl-
  • 1,3,2-Dioxaborinane, 2,2'-((1,1,3-trimethyltrimethylene)dioxy)bis(4,4,6-trimethyl)-
  • 2,4-Pentanediol, 2-methyl-, cyclic borate, 1,1,3-trimethyltrimethylene ester
  • 4-01-00-02568 (Beilstein Handbook Reference)
  • Borester 7
  • BRN 1804905
  • EINECS 202-899-7
  • NSC 788
  • Tri(2-methyl-2,4-pentanediol)biborate
  • Trihexylene glycol biborate
  • Trihexylene glycol biborate, triethanolamine titanate complex
  • Trihexylene glycol diborate
  • USAF BO-1
  • WT 17

Systematic Names

  • 1,3,2-Dioxaborinane, 2,2'-((1,1,3-trimethyl-1,3-propanediyl)bis(oxy))bis(4,4,6-trimethyl-
  • 2,2'-((1,1,3-Trimethylpropane-1,3-diyl)bis(oxy))bis(4,4,6-trimethyl-1,3,2-dioxaborinane)
  • 2,4-Pentanediol, 2-methyl-, ester with boric acid (H3-B-O3) (1:2) cyclic bis(1,1,3-trimethylmethylene) ester
  • Boric acid, tris(1,1,3-trimethyltrimethylene) ester (7CI)

Registry Numbers

CAS Registry Number

  • 100-89-0

Other Registry Numbers

  • 115-81-1
  • 139-04-8
  • 68189-08-2

System Generated Number

  • 0000100890

Structure Descriptors

InChI

1S/C18H36B2O6/c1-13-10-16(4,5)24-19(21-13)22-14(2)11-17(6,7)25-20-23-15(3)12-18(8,9)26-20/h13-15H,10-12H2,1-9H3

InChIKey

QXMQBCRKITYLGR-UHFFFAOYSA-N

Smiles

B1(OC(C)(C)C[C@@H](O1)C)OC(C[C@@H](OB1OC(C)(C)C[C@@H](O1)C)C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 750mg/kg (750mg/kg)   National Technical Information Service. Vol. AD277-689,
rat LD50 oral 4724mg/kg (4724mg/kg) SKIN AND APPENDAGES (SKIN): HAIR: OTHER

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: ATAXIA
National Technical Information Service. Vol. OTS0536626,