CAS 121-06-2

2,6-Xylyl phosphate

Description:

2,6-Xylyl phosphate, with the CAS number 121-06-2, is an organophosphate compound characterized by its phosphate ester structure. It is derived from xylenes, specifically the 2,6-dimethylphenol, and is typically used as a flame retardant and plasticizer in various industrial applications. The compound is known for its moderate to low toxicity, although it can pose environmental hazards, particularly in aquatic systems. Physically, 2,6-xylyl phosphate is a colorless to pale yellow liquid with a characteristic odor. It is soluble in organic solvents but has limited solubility in water. The compound exhibits properties typical of organophosphates, including the ability to inhibit certain enzymes, which can affect biological systems. Due to its chemical structure, it can participate in various chemical reactions, making it useful in synthetic organic chemistry. Safety measures should be observed when handling this substance, as it can be harmful if ingested or inhaled, and appropriate personal protective equipment is recommended.

Formula: C₂₄H₂₇O₄P

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

InChI key: InChIKey=QLORRTLBSJTMSN-UHFFFAOYSA-N

SMILES: O(P(OC1=C(C)C=CC=C1C)(OC2=C(C)C=CC=C2C)=O)C3=C(C)C=CC=C3C

Synonyms:

• Tri-2,6-xylyl phosphate
• 2,6-Xylenol, phosphate (3:1)
• Phenol, 2,6-dimethyl-, phosphate (3:1)
• 2,6-Xylyl phosphate ((C8H9O)3PO)
• 2,6-Xylyl phosphate
• tris(2,6-dimethylphenyl) phosphate
• TRIS(2,6-XYLENYL)PHOSPHATE

2,6-Xylyl Phosphate

Controlled Product

CAS: 121-06-2

Formula: C₂₄H₂₇O₄P

Color and Shape: Neat

Molecular weight: 410.45

Ref: TR-X747480