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Substance Name: Tribenzoin
RN: 614-33-5
UNII: 3LZY0X529Y
InChIKey: HIZCTWCPHWUPFU-UHFFFAOYSA-N

Molecular Formula

  • C24-H20-O6

Molecular Weight

  • 404.416
 
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Names and Synonyms

Results Name

  • Tribenzoin

Name of Substance

  • Tribenzoin

Synonyms

  • 1,2,3-Propanetriol, tribenzoate
  • AI3-08196
  • EINECS 210-379-6
  • FEMA No. 3398
  • Glycerol tribenzoate
  • Glyceryl tribenzoate
  • NSC 2230
  • Tribenzoin
  • UNII-3LZY0X529Y

Systematic Names

  • 1,2,3-Propanetriol, 1,2,3-tribenzoate
  • 1,2,3-Propanetriol, tribenzoate
  • Glycerol tribenzoate

Superlist Name

  • Tribenzoin

Registry Numbers

CAS Registry Number

  • 614-33-5

FDA UNII

  • 3LZY0X529Y

System Generated Number

  • 0000614335

Structure Descriptors

InChI

1S/C24H20O6/c25-22(18-10-4-1-5-11-18)28-16-21(30-24(27)20-14-8-3-9-15-20)17-29-23(26)19-12-6-2-7-13-19/h1-15,21H,16-17H2

InChIKey

HIZCTWCPHWUPFU-UHFFFAOYSA-N

Smiles

c1(C(OC(COC(c2ccccc2)=O)COC(c2ccccc2)=O)=O)ccccc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 76 deg C   EXP
log P (octanol-water) 4.730 (none)   EST
Atmospheric OH Rate Constant 1.14E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.