Fenoprofen Calcium Dihydrate

Basic Information

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CAS Number

53746-45-5

Molecular Formula

C30H30CaO8

Molecular Weight

558.6 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

381.3°C at 760 mmHg

Flash Point

141.7°C

SMILES

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CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-].CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-].O.O.[Ca+2]

InChI

InChI=1S/2C15H14O3.Ca.2H2O/c2*1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13;;;/h2*2-11H,1H3,(H,16,17);;2*1H2/q;;+2;;/p-2

InChIKey

LZPBLUATTGKZBH-UHFFFAOYSA-L

LogP

7.05120

pKa

4.5(at 25℃)

Complexity

265

Safety Information

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Hazard Statement

Toxicity

LD50 orally in mice: 800 mg/kg (Emmerson)

Synonyms & References

English

Progesic dihydrate
NCGC00094887-05
CALCIUM (+/-)-M-PHENOXYHYDRATROPATE DIHYDRATE
Fenoprofen calcium [USAN:USP:BAN:JAN]
(+-)-alpha-Methyl-3-phenoxybenzeneacetic acid calcium salt dihydrate
Prestwick_221
Lilly 69323
CCG-220754
D00968
Propionic acid, 2-(3-phenoxyphenyl)-, calcium salt, dihydrate, dl-
53746-45-5
HMS3714G10
calcium;2-(3-phenoxyphenyl)propanoate;dihydrate
FENOPROFEN CALCIUM [USP-RS]
Feprona dihydrate
Nalgesic
calcium 2-(3-phenoxyphenyl)propionate dihydrate
71720-56-4
Z1552187007
Calcium 2-(m-phenoxyphenyl)propionate dihydrate
Fenoprofencalciumdihydrate
HMS1570G10
A829759
Fenoprofen Calcium Dihydrate; Fenoprofen calcium salt dihydrate; Benzeneacetic acid, alpha-methyl-3-phenoxy-, calcium salt, hydrate (2:1:2); Benzeneacetic acid, alpha-methyl-3-phenoxy-, calcium salt, dihydrate (9CI)
Nalfon (TN)
fenoprofen calcium 2H2O
FENOPROFEN CALCIUM [VANDF]
FENOPROFEN CALCIUM SALT DIHYDRATE [MI]
CAS-71720-56-4
Fepron
FENOPROFEN CALCIUM [JAN]

MDL Number

MFCD00150770

FAQ

What are the physical and chemical properties of Fenoprofen Calcium Dihydrate (CAS: 53746-45-5)?

Fenoprofen Calcium Dihydrate is a crystalline compound with a molecular weight of approximately 380.3 g/mol. It has a solubility of about 3.5 g/L in water at 25°C. The compound is slightly acidic due to the presence of calcium and is relatively stable under normal conditions but can react with strong bases. It is commonly used in pharmaceutical applications and should be stored in dry conditions to prevent hydrolysis.

How is Fenoprofen Calcium Dihydrate (CAS: 53746-45-5) typically synthesized?

Fenoprofen Calcium Dihydrate is synthesized through a multi-step process involving the reaction of fenoprofen with calcium hydroxide. The process typically includes the preparation of fenoprofen, followed by its reaction with an excess of calcium hydroxide in aqueous solution. The dihydrate form is obtained through crystallization. The yield is around 90%, and common solvents used include water and ethanol.

What industries use Fenoprofen Calcium Dihydrate (CAS: 53746-45-5)?

Fenoprofen Calcium Dihydrate is primarily used in the pharmaceutical industry as an anti-inflammatory and analgesic drug. It is also used in veterinary medicine for similar purposes. Due to its chemical structure, it can be incorporated into various formulations, such as tablets, capsules, and topical creams. The compound is less commonly used in other industries like polymers, sensors, or semiconductors.

What precautions should be taken when handling Fenoprofen Calcium Dihydrate (CAS: 53746-45-5)?

When handling Fenoprofen Calcium Dihydrate, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood to minimize exposure to airborne particles. Spills should be cleaned up with caution, using appropriate absorbent materials. In case of accidental ingestion, seek medical attention immediately. Refer to the Safety Data Sheet (SDS) for detailed instructions and emergency procedures.