CAS 39800-28-7

2H-1,3,2-Oxazaphosphorin-2-amine, N,3-bis(2-chloroethyl)tetrahydro-4-hydroperoxy-, 2-oxide

Description:

2H-1,3,2-Oxazaphosphorin-2-amine, N,3-bis(2-chloroethyl)tetrahydro-4-hydroperoxy-, 2-oxide, commonly referred to by its CAS number 39800-28-7, is a chemical compound that belongs to the class of oxazaphosphorines. This compound features a phosphorus atom bonded to an oxazaphosphorine ring, which contributes to its unique chemical properties. It contains chloroethyl groups, which are known for their reactivity and potential use in various chemical reactions, particularly in the synthesis of pharmaceuticals and agrochemicals. The hydroperoxy group in its structure indicates the presence of a peroxide functional group, which can impart oxidative properties. This compound may exhibit biological activity, making it of interest in medicinal chemistry, particularly in the development of anticancer agents. However, due to the presence of chlorine atoms, it may also pose environmental and health risks, necessitating careful handling and assessment of its safety profile. Overall, its complex structure and functional groups suggest a range of potential applications and reactivity in organic synthesis.

Formula: C₇H₁₅Cl₂N₂O₄P

InChI: InChI=1S/C7H15Cl2N2O4P/c8-2-4-10-16(13)11(5-3-9)7(15-12)1-6-14-16/h7,12H,1-6H2,(H,10,13)

InChI key: InChIKey=YGZIWEZFFBPCLN-UHFFFAOYSA-N

SMILES: C(CCl)N1P(NCCCl)(=O)OCCC1OO

Synonyms:

• 2H-1,3,2-Oxazaphosphorin-2-amine, N,3-bis(2-chloroethyl)tetrahydro-4-hydroperoxy-, 2-oxide
• 4-Hydroperoxyisophosphamide
• Hydroperoxide, 3-(2-chloroethyl)-2-[(2-chloroethyl)amino]tetrahydro-2H-1,3,2-oxazaphosphorin-4-yl, P-oxide
• Hydroperoxide, 3-(2-chloroethyl)-2-[(2-chloroethyl)amino]tetrahydro-2-oxido-2H-1,3,2-oxazaphosphorin-4-yl
• 2H-1,3,2-Oxazaphosphorine, hydroperoxide deriv.

4-Hydroperoxyifosfamide

CAS: 39800-28-7

4-Hydroperoxyifosfamide is an anticancer agent capable of penetrating the blood-brain barrier (BBB) [1].

Formula: C₇H₁₅Cl₂N₂O₄P

Color and Shape: Solid

Molecular weight: 293.09

Ref: TM-T83317