CAS 789440-10-4

Bis(2-chloro-1-methylethyl) hydrogen phosphate

Description:

Bis(2-chloro-1-methylethyl) hydrogen phosphate, with the CAS number 789440-10-4, is an organophosphate compound characterized by its phosphate functional group and two chloroalkyl substituents. This substance typically appears as a colorless to pale yellow liquid and is known for its potential use in various applications, including as a chemical intermediate or in the synthesis of other compounds. The presence of chlorine atoms in its structure contributes to its reactivity and potential biological activity. Organophosphates, including this compound, can exhibit toxicity, particularly as they may inhibit acetylcholinesterase, an important enzyme in the nervous system. Therefore, handling this substance requires caution, and appropriate safety measures should be implemented to mitigate exposure risks. Its solubility in organic solvents and limited water solubility are also notable characteristics, influencing its behavior in environmental and biological systems. Overall, Bis(2-chloro-1-methylethyl) hydrogen phosphate is a significant compound within the realm of organophosphates, warranting careful study and consideration in both industrial and research contexts.

Formula: C₆H₁₃Cl₂O₄P

InChI: InChI=1S/C6H13Cl2O4P/c1-5(3-7)11-13(9,10)12-6(2)4-8/h5-6H,3-4H2,1-2H3,(H,9,10)

InChI key: InChIKey=ORAAZVDXWSKZHK-UHFFFAOYSA-N

SMILES: O(P(OC(CCl)C)(=O)O)C(CCl)C

Synonyms:

• Bis(2-chloro-1-methylethyl) hydrogen phosphate
• Bis(1-chloro-2-propyl) phosphate
• 2-Propanol, 1-chloro-, 2,2′-(hydrogen phosphate)
• 2-Propanol, 1-chloro-, hydrogen phosphate
• bis(1-chloro-2-propyl) phosphate (BCIPP)
• Bis(2-chloropropyl) phosphate

Bis-(1-Chloro-2-propyl)phosphate-d12, 90%

Controlled Product

CAS: 789440-10-4

Stability Hygroscopic
Applications Labelled Bis-(1-Chloro-2-propyl)phosphate is the metabolite of organic flame retardants.
References Schindler, B. et al.: Anal. Bioanal. Chem., 395, 1167 (2009);

Formula: C₆D₁₂HCl₂O₄P

Purity: 90%

Color and Shape: Colourless To Brown

Molecular weight: 263.119

Ref: TR-B419092

Bis-(1-chloro-2-propyl)phosphate (Mixture of isomers)

Controlled Product

CAS: 789440-10-4

Applications Bis-(1-Chloro-2-propyl)phosphate is the metabolite of organic flame retardants.
References Schindler, B. et al.: Anal. Bioanal. Chem., 395, 1167 (2009);

Formula: C₆H₁₃Cl₂O₄P

Color and Shape: Colourless To Light Brown

Molecular weight: 251.04

Ref: TR-B419090