P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid | CAS No. 851456-00-3

P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid

Basic Information

CAS Number

851456-00-3

Molecular Formula

C15H25N6O5P

Molecular Weight

400.38 g/mol

AD

Basic Physical Properties

C[C@H](Cn1cnc2c1ncnc2N)OCP(=O)(N[C@@H](C)C(=O)OC(C)C)O

InChI

InChI=1S/C15H25N6O5P/c1-9(2)26-15(22)11(4)20-27(23,24)8-25-10(3)5-21-7-19-12-13(16)17-6-18-14(12)21/h6-7,9-11H,5,8H2,1-4H3,(H2,16,17,18)(H2,20,23,24)/t10-,11+/m1/s1

InChIKey

BOVSGPQGGHVIEX-MNOVXSKESA-N

LogP

0.8861999999999994

Topological Polar Surface Area

154.48 Ų

Hydrogen Bond Donor/Acceptor

4 / 11

Complexity

553

Synonyms & References

English

  • Tenofovir Related Compound 4
  • [(2R)-1-(6-Aminopurin-9-yl)propan-2-yl]oxymethyl-N-[(2S)-1-oxo-1-propan-2-yloxypropan-2-yl]phosphona

MDL Number

MFCD32068304

FAQ

What are the physical and chemical properties of P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid (CAS: 851456-00-3)?

P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid is a crystalline compound with a molecular weight of approximately 642.37 g/mol. It is soluble in water and organic solvents. The compound exhibits moderate reactivity, particularly towards nucleophilic substitution reactions.

How is P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid (CAS: 851456-00-3) typically synthesized?

P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid is synthesized via a multi-step process involving the protection of the amino group, phosphonation, and subsequent deprotection. Commonly used catalysts include various organometallic reagents, and the overall yield is around 70-80%.

What industries use P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid (CAS: 851456-00-3)?

P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid is primarily used in pharmaceuticals for developing new drugs. It may also have potential applications in the synthesis of polymers and as a reagent in analytical chemistry for sensor development and semiconductors.

What precautions should be taken when handling P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid (CAS: 851456-00-3)?

When handling P-({[(2R)-1-(6-Amino-9H-purin-9-yl)-2-propanyl]oxy}methyl)-N-[(2S)-1-isopropoxy-1-oxo-2-propanyl]phosphonamidic acid, proper personal protective equipment (PPE) should be used, including gloves, goggles, and a lab coat. Work should be conducted in a fume hood to avoid inhalation. In case of spill, neutralize the spill with an appropriate base and then clean up according to standard safety protocols. Always refer to the Safety Data Sheet (SDS) for detailed handling information.

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