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Estrone, acetate structure
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Estrone, acetate

TL;DR: Estrone, acetate (CAS 901-93-9) is a chemical compound with molecular formula C20H24O3 and molecular weight 312.17255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) acetate

Also Known As: estrone acetate, Estrone, acetate, Acetoxyestrone, 3-Acetoxyestrone, RUCAPARIB

CAS Number
901-93-9
Molecular Formula
C20H24O3
Molecular Weight
312.17255 g/mol
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Technical Specifications

Molecular FormulaC20H24O3
Molecular Weight312.17255 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)43.4 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass312.17255 Da
Heavy Atoms23
Complexity513.0
SMILESCC(=O)OC1=CC2=C(C=C1)C3CCC4(C(C3CC2)CCC4=O)C
InChIKeyKDPQTPZDVJHMET-UHFFFAOYSA-N

Product Description

Applications: Estrone, acetate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A fine chemical supplied by CoreyChem, Estrone, acetate (CAS 901-93-9) has the molecular formula C20H24O3 and a molecular weight of 312.17 g/mol. Synonyms include estrone acetate and Estrone, acetate.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Estrone, acetate

XLogP
3.2
TPSA (Topological Polar Surface Area)
43.4
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
23
Complexity
513.0
Exact Mass
312.17255
Monoisotopic Mass
312.17255
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Estrone, acetate

The XLogP value of 3.2 indicates that Estrone, acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, Estrone, acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Estrone, acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Estrone, acetate?

The CAS number of Estrone, acetate is 901-93-9.

What is the molecular formula of Estrone, acetate?

The molecular formula of Estrone, acetate is C20H24O3.

What is the molecular weight of Estrone, acetate?

The molecular weight of Estrone, acetate is 312.17255 g/mol.

What are the applications of Estrone, acetate?

Estrone, acetate is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Where can I buy Estrone, acetate?

You can request a quote for Estrone, acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Estrone, acetate?

Yes, CoreyChem provides custom synthesis services for Estrone, acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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