Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate (1:2:1) | CAS No. 331748-07-3

Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate (1:2:1)

Basic Information

CAS Number

331748-07-3

Molecular Formula

C18H34CaN2O11

Molecular Weight

494.5 g/mol

AD

Basic Physical Properties

Melting Point

138°C

CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.CC(C)(CO)C(C(=O)NCCC(=O)[O-])O.O.[Ca+2]

InChI

InChI=1S/2C9H17NO5.Ca.H2O/c2*1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;;/h2*7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);;1H2/q;;+2;/p-2

InChIKey

KUKRZUPDYACRAM-UHFFFAOYSA-L

LogP

-4.03850

Complexity

233

Safety Information

View Safety Information

Sensitiveness

Hygroscopic

Synonyms & References

English

  • D-Pantothenic acid calcium salt hydrate
  • Calcium 3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoate hydrate
  • 331748-07-3
  • 63409-48-3
  • calcium;3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate;hydrate
  • Calcium3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoatehydrate
  • calcium bis{3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate} hydrate
  • calcium d-pantothenate hydrate

MDL Number

MFCD00149115

Customs Code

2936240000

FAQ

What are the physical and chemical properties of Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate (CAS: 331748-07-3)?

Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate (CAS: 331748-07-3) is a hydrate compound with a molecular weight of approximately 410.5 g/mol. It is a white crystalline solid with good solubility in water and limited solubility in organic solvents. The compound exhibits moderate reactivity with bases and a low tendency to decompose under normal conditions. It is stable under acidic conditions but can react with strong acids to form free calcium salts.

How is Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate (CAS: 331748-07-3) typically synthesized?

Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate is typically synthesized by reacting calcium carbonate with 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoic acid in the presence of water. Commonly, the reaction is carried out under mild conditions, with a yield of around 85%. The process involves careful control of pH and temperature to ensure the formation of the hydrate form.

What industries use Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate (CAS: 331748-07-3)?

Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate (CAS: 331748-07-3) is used in various industries including pharmaceuticals for its potential as a calcium source and in polymer applications for its chelating properties. It is also utilized in sensor technology due to its reactivity and in semiconductor manufacturing for cleaning and etching processes.

What precautions should be taken when handling Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate (CAS: 331748-07-3)?

When handling Calcium 3-[(2,4-dihydroxy-3,3-dimethylbutanoyl)amino]propanoate hydrate (CAS: 331748-07-3), it is essential to use appropriate personal protective equipment (PPE) such as gloves and goggles. Store the compound in a cool, dry place away from strong acids and bases. In case of a spill, immediately contain the spill and clean it up using appropriate absorbents. Always consult the Safety Data Sheet (SDS) for detailed handling and storage instructions.

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