Sodium (3S,4R,5R)-6-((hydrogenphosphonato)oxy)-3,4,5-trihydroxy-2-oxohexyl phosphate

Basic Information

View in Editor

CAS Number

38099-82-0

Molecular Formula

C6H11Na3O12P2

Molecular Weight

406.06 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Agricultural Chemicals Pesticides Insecticides

Basic Physical Properties

Melting Point

72-80°C

Boiling Point

722.6°C at 760 mmHg

Density

2.095

Flash Point

390.8°C

SMILES

View in Editor

C(C(C(C(C(=O)COP(=O)(O)[O-])O)O)O)OP(=O)([O-])[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C6H14O12P2.3Na/c7-3(1-17-19(11,12)13)5(9)6(10)4(8)2-18-20(14,15)16;;;/h3,5-7,9-10H,1-2H2,(H2,11,12,13)(H2,14,15,16);;;/q;3*+1/p-3/t3-,5-,6-;;;/m1.../s1

InChIKey

CEHGLSKJDFICTB-PWVOXRODSA-K

LogP

-1.67120

Complexity

396

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

Diphosphofructose trisodium
38099-82-0
FDP trisodium
UNII-T1E52G2C9I
AKOS025311042
D95828
D-Fructose, 1,6-bis(dihydrogen phosphate), trisodium salt
Esafosfan trisodium
D-Fructose-1,6-diphosphate trisodium salt
D-Fructose, 1,6-bis(dihydrogen phosphate), sodium salt (1:3)
EINECS 253-778-0
D-Fructose-1,6-diphosphate trisodium salt octahydrate
Fosfructose (trisodium)
T1E52G2C9I
Hexose diphosphate
sodium (2R,3R,4S)-6-(hydrogenphosphonatooxy)-2,3,4-trihydroxy-5-oxohexyl phosphate
Fosfructose trisodium anhydrous
trisodium;[(2R,3R,4S)-2,3,4-trihydroxy-6-[hydroxy(oxido)phosphoryl]oxy-5-oxohexyl] phosphate
Fosfructose trisodium
MFCD00135872
Fructose-1,6-bis(dihydrophosphate), trisodium salt
D-Fructose 1,6-bisphosphate trisodium salt
Diphosphofructose (trisodium);Esafosfan (trisodium);FDP (trisodium)
D-Fructose 1,6-bisphosphate trisodium salt octahydrate
Fructose 1,6-Diphosphate Trisodium
1,6-bis(dihydrogen phosphate),sodium salt
6-diphosphate trisodiuM salt octahydrate
D-fructose 1,6-bis(dihydrogen phosphate),trisodium salt
D-FRUCTOSE 1,6-DIPHOSPHATE TRISODIUM SALT
D-Fructose-1
FDP-Na3H

MDL Number

MFCD00068321

FAQ

What are the physical and chemical properties of Sodium (3S,4R,5R)-6-((hydrogenphosphonato)oxy)-3,4,5-trihydroxy-2-oxohexyl phosphate (CAS: 38099-82-0)?

Sodium (3S,4R,5R)-6-((hydrogenphosphonato)oxy)-3,4,5-trihydroxy-2-oxohexyl phosphate, or Na(PH2O6), is a crystalline compound with a molecular weight of approximately 228.25 g/mol. It has a high solubility in water and a low reactivity under normal conditions. It is stable in air and light but can degrade under basic conditions. This compound shows good stability in acidic environments and is resistant to hydrolysis at temperatures below 100°C.

How is Sodium (3S,4R,5R)-6-((hydrogenphosphonato)oxy)-3,4,5-trihydroxy-2-oxohexyl phosphate (CAS: 38099-82-0) typically synthesized?

Sodium (3S,4R,5R)-6-((hydrogenphosphonato)oxy)-3,4,5-trihydroxy-2-oxohexyl phosphate is typically synthesized by reacting 6-phosphogluconic acid with sodium hydroxide. The reaction involves the conversion of 6-phosphogluconic acid to its sodium salt, followed by the introduction of a phosphonate group via a phosphonate esterification step. The product is then purified through column chromatography or crystallization for further use.

What industries use Sodium (3S,4R,5R)-6-((hydrogenphosphonato)oxy)-3,4,5-trihydroxy-2-oxohexyl phosphate (CAS: 38099-82-0)?

Sodium (3S,4R,5R)-6-((hydrogenphosphonato)oxy)-3,4,5-trihydroxy-2-oxohexyl phosphate is used in the pharmaceutical industry, particularly in the development of certain drugs and as a component in some medical formulations. It is also utilized in the polymer industry as a stabilizer or additive, and in the sensor and semiconductor industries for specific functional applications.

What precautions should be taken when handling Sodium (3S,4R,5R)-6-((hydrogenphosphonato)oxy)-3,4,5-trihydroxy-2-oxohexyl phosphate (CAS: 38099-82-0)?

When handling Sodium (3S,4R,5R)-6-((hydrogenphosphonato)oxy)-3,4,5-trihydroxy-2-oxohexyl phosphate, it is important to wear appropriate personal protective equipment (PPE) such as gloves and safety goggles. The compound should be handled in a well-ventilated area, preferably in a fume hood, to avoid inhalation. Spills should be cleaned up with caution, using appropriate absorbent materials, and the area should be thoroughly washed down with water. Always refer to the Safety Data Sheet (SDS) for specific handling and storage guidelines.