O-Phosphonothreonine

Basic Information

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CAS Number

1114-81-4

Molecular Formula

C4H10NO6P

Molecular Weight

199.1 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Agricultural Chemicals Pesticides Insecticides

Water Treatment Chemicals Coagulants and Flocculants Inorganic Coagulants

Basic Physical Properties

Solubility

NH4OH 1 M: 0.1 g/mL, clear, colorless

SMILES

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CC(C(C(=O)O)N)OP(=O)(O)O

InChI

InChI=1S/C4H10NO6P/c1-2(3(5)4(6)7)11-12(8,9)10/h2-3H,5H2,1H3,(H,6,7)(H2,8,9,10)

InChIKey

USRGIUJOYOXOQJ-UHFFFAOYSA-N

LogP

-1.1039

Topological Polar Surface Area

130.08 Å²

Hydrogen Bond Donor/Acceptor

5 / 7

Complexity

195

Synonyms & References

English

L-Threonine,O-phosphono-
L-2-AMINO-3-HYDROXYBUTANOIC ACID 3-PHOSPHATE
H-THR(PO3H2)-OH
O-PHOSPHO-L-THREONINE
PHOSPHOTHREONINE ANTIBODY INHIBITOR
threoninium dihydrogen phosphate
Threonine phosphate
(s)-2-amino-3-hydroxybutanoic acid 3-phosphate
H-Thr(PO?H?)-OH
O-PHOSPHO-L-THREONINE FREE ACID
(S)-2-Amino-3-hydroxybutanoic acid 3-phosphate,L-Threonine O-phosphate
L-Threonine dihydrogen phosphate
L-THREONINE O-PHOSPHATE
O-Phospho-threonin
O-Phosphothreonine
Phosphothreonin
(S)-2-Amino-3-hydroxybutanoic acid 3-phosphate
L-Threonine O-phosphate

MDL Number

MFCD00069578

Customs Code

2931900090

FAQ

What are the physical and chemical properties of O-Phosphonothreonine (CAS: 1114-81-4)?

O-Phosphonothreonine (CAS: 1114-81-4) is a crystalline solid with a molecular weight of approximately 187.15 g/mol. It is slightly soluble in water and has poor solubility in common organic solvents. Chemically, it exhibits typical reactivity for phosphonic acid derivatives, making it susceptible to nucleophilic substitution and hydrolysis under basic conditions.

How is O-Phosphonothreonine (CAS: 1114-81-4) typically synthesized?

O-Phosphonothreonine (CAS: 1114-81-4) is typically synthesized through the phosphoramidation of threonine using phosphorus oxychloride and a base catalyst. The reaction is selective and yields a product with high purity. The process requires careful temperature control to ensure optimal yield and selectivity.

What industries use O-Phosphonothreonine (CAS: 1114-81-4)?

O-Phosphonothreonine (CAS: 1114-81-4) finds applications in pharmaceuticals, particularly in the development of nucleoside analogs and antiviral drugs. It is also used in the synthesis of certain polymers and as a reagent in biochemical assays.

What precautions should be taken when handling O-Phosphonothreonine (CAS: 1114-81-4)?

When handling O-Phosphonothreonine (CAS: 1114-81-4), it is important to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be stored in a fume hood and handled in a well-ventilated area to minimize inhalation risks. Spills should be cleaned up using appropriate absorbent materials, and the area should be neutralized with a suitable solution. Safety Data Sheets (SDS) should be consulted for detailed safety information.