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Substance Name: Tris(2,5-xylenyl)phosphate
RN: 19074-59-0
UNII: PP52A5JDYU
InChIKey: MDHAARLWBHZGIP-UHFFFAOYSA-N

Molecular Formula

  • C24-H27-O4-P

Molecular Weight

  • 410.4473
 
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Names and Synonyms

Name of Substance

  • Tris(2,5-xylenyl)phosphate

Synonyms

  • 2,5-Xylenol, phosphate (3:1)
  • EINECS 242-799-0
  • HSDB 3909
  • NSC 66475
  • Phenol, 2,5-dimethyl-, phosphate (3:1)
  • Phosphoric acid, tris(2,5-dimethylphenyl) ester
  • Tri(2,5-dimethylphenyl) phosphate
  • Tri(2,5-xylenyl)phosphate
  • UNII-PP52A5JDYU

Systematic Names

  • 2,5-Xylenol, phosphate (3:1) (8CI)
  • Phenol, 2,5-dimethyl-, phosphate (3:1)
  • Phenol, 2,5-dimethyl-, phosphate (3:1) (9CI)
  • Tris(2,5-xylyl) phosphate

Registry Numbers

CAS Registry Number

  • 19074-59-0

FDA UNII

  • PP52A5JDYU

System Generated Number

  • 0019074590

Structure Descriptors

InChI

1S/C24H27O4P/c1-16-7-10-19(4)22(13-16)26-29(25,27-23-14-17(2)8-11-20(23)5)28-24-15-18(3)9-12-21(24)6/h7-15H,1-6H3

InChIKey

MDHAARLWBHZGIP-UHFFFAOYSA-N

Smiles

P(=O)(Oc1c(ccc(c1)C)C)(Oc1c(ccc(c1)C)C)Oc1c(ccc(c1)C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 79.8 deg C   EXP
log P (octanol-water) 7.980 (none)   EST
Water Solubility 7.05E-04 mg/L 25 EST
Vapor Pressure 2.63E-08 mm Hg 25 EST
Henry's Law Constant 7.19E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.55E-11 cm3/molecule-sec 25 EST

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