Calcium hydrogen (2S)-2-aminosuccinate (1:2:2)

Basic Information

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CAS Number

39162-75-9

Molecular Formula

C8H12CaN2O8

Molecular Weight

304.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Physical Properties

Melting Point

270-271ºC

Boiling Point

264.1 °C at 760 mmHg

Density

1.514

Flash Point

113.5 °C

SMILES

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C(C(C(=O)[O-])N)C(=O)O.C(C(C(=O)[O-])N)C(=O)O.[Ca+2]

InChI

InChI=1S/2C4H7NO4.Ca/c2*5-2(4(8)9)1-3(6)7;/h2*2H,1,5H2,(H,6,7)(H,8,9);/q;;+2/p-2/t2*2-;/m00./s1

InChIKey

VAFAEQCKZBKRLZ-CEOVSRFSSA-L

LogP

-1.00760

Complexity

127

Synonyms & References

English

Calcium (S)-2-amino-3-carboxypropanoate
L-Aspartic acid calcium salt
39162-75-9
SCHEMBL120544
calcium l-aspartate
Calcium(S)-2-amino-3-carboxypropanoate(1:x)
Calcium (S)-2-amino-3-carboxypropanoate(1:x)
21059-46-1
calcium;(2S)-2-amino-4-hydroxy-4-oxobutanoate
Calcium (3S)-3-amino-4-hydroxy-4-oxobutanoate
CALCIUM DIHYDROGEN DI-L-ASPARTATE

MDL Number

MFCD23382353

Customs Code

2922499990

FAQ

What are the physical and chemical properties of Calcium hydrogen (2S)-2-aminosuccinate (1:2:2) (CAS: 39162-75-9)?

Calcium hydrogen (2S)-2-aminosuccinate (1:2:2) (CAS: 39162-75-9) is a white crystalline solid with a molecular weight of approximately 296.3 g/mol. It is slightly soluble in water and ethanol. This compound is known for its reducing properties and can react with various metal ions and oxidizing agents. It is also stable under normal conditions but may decompose at high temperatures.

How is Calcium hydrogen (2S)-2-2-aminosuccinate (1:2:2) (CAS: 39162-75-9) typically synthesized?

Calcium hydrogen (2S)-2-aminosuccinate (1:2:2) (CAS: 39162-75-9) can be synthesized by reacting calcium hydrogen succinate with (2S)-2-aminosuccinic acid in a 1:2 molar ratio. The reaction is typically conducted in water at a neutral pH, using mild conditions to ensure high selectivity and yield. Catalysts such as sodium bicarbonate can be used to enhance the reaction efficiency.

What industries use Calcium hydrogen (2S)-2-2-aminosuccinate (1:2:2) (CAS: 39162-75-9)?

Calcium hydrogen (2S)-2-aminosuccinate (1:2:2) (CAS: 39162-75-9) is primarily used in the pharmaceutical industry due to its potential as a chelating agent and as a precursor for other pharmaceutical compounds. It is also utilized in the polymer industry for its ability to improve the properties of polymers. Additionally, it has applications in sensors and semiconductors for its unique chemical properties.

What precautions should be taken when handling Calcium hydrogen (2S)-2-2-aminosuccinate (1:2:2) (CAS: 39162-75-9)?

When handling Calcium hydrogen (2S)-2-aminosuccinate (1:2:2) (CAS: 39162-75-9), it is important to wear proper personal protective equipment (PPE), including gloves and safety goggles. This compound should be stored in a cool, dry place away from direct sunlight and heat sources. It is not hazardous to handle, but care should be taken to avoid inhalation or skin contact. In the event of a spill, it should be cleaned up using standard laboratory procedures, and the area should be ventilated. For more detailed information, consult the Safety Data Sheet (SDS) provided by the manufacturer.