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(17beta)-17-Hydroxyestra-1(10),2,4-trien-3-yl benzoate(CAS: 50-50-0)

(17beta)-17-Hydroxyestra-1(10),2,4-trien-3-yl benzoate
CAS Number

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Basic Information

Molecular Formula
C25H28O3
Molecular Weight
376.5 g/mol
Physical State
Powder

Physical Properties

Melting Point
191-198?°C(lit.)
Boiling Point
531.2°C at 760mmHg
Flash Point
212°C

Chemical Identifiers

SMILES
C[C@@]12CC[C@H]3[C@@H](CCc4cc(OC(=O)c5ccccc5)ccc34)[C@@H]2CC[C@@H]1O
InChIKey
UYIFTLBWAOGQBI-BZDYCCQFSA-N

Database References

MDL Number
MFCD00003692

FAQ

This compound, with the CAS number 50-50-0, is a derivative of estradiol, a key estrogen hormone. Its chemical formula is C25H32O3, and it features a benzoate ester group attached to the estradiol core. It is a white crystalline solid, soluble in organic solvents, and has a molecular weight of 376.52 g/mol. It is primarily used in pharmaceutical research for its biological activity related to estrogen receptor modulation.
This compound is mainly used in pharmaceuticals as a prodrug or intermediate for estrogen-based therapies. It also serves in research for studying hormonal mechanisms and in industrial applications for synthesizing related compounds. Additionally, it is utilized in biochemical assays to evaluate estrogen receptor interactions and in veterinary medicine for hormone regulation studies.
Safety of this compound depends on exposure conditions. It is generally considered safe when handled properly, but it may have mild toxicity if ingested or inhaled. Protective measures include wearing gloves, goggles, and a lab coat. Safety standards recommend avoiding contact with skin and eyes, and it should be stored in a secure location to prevent accidental exposure to humans and animals.
This compound should be stored in a cool, dry place away from light. Maintain temperature between 2-8°C and humidity below 60% to ensure stability. Use airtight, dark-colored containers to prevent degradation. Avoid exposure to strong oxidizing agents and store in a well-ventilated area to minimize risks associated with improper storage conditions.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures

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