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Trihydroxycoprostane structure
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Trihydroxycoprostane

TL;DR: Trihydroxycoprostane (CAS 547-96-6) is a chemical compound with molecular formula C27H48O3 and molecular weight 420.36035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol

Also Known As: Trihydroxycoprostane, trihydroxycholestane, 3,7,12-Trihydroxycoprostane, 10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol

CAS Number
547-96-6
Molecular Formula
C27H48O3
Molecular Weight
420.36035 g/mol
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Technical Specifications

Molecular FormulaC27H48O3
Molecular Weight420.36035 g/mol
XLogP6.7
Topological Polar Surface Area (TPSA)60.7 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors3
Rotatable Bonds5
Exact Mass420.36035 Da
Heavy Atoms30
Complexity605.0
SMILESCC(C)CCCC(C)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
InChIKeyRIVQQZVHIVNQFH-UHFFFAOYSA-N

Product Description

Applications: Trihydroxycoprostane 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).

Trihydroxycoprostane is a fine chemical identified by CAS number 547-96-6 and the molecular formula C27H48O3 and a molecular weight of 420.36 g/mol. Synonyms include Trihydroxycoprostane and trihydroxycholestane.

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 Trihydroxycoprostane

XLogP
6.7
TPSA (Topological Polar Surface Area)
60.7
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
3
Rotatable Bonds
5
Heavy Atoms
30
Complexity
605.0
Exact Mass
420.36035
Monoisotopic Mass
420.36035
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 Trihydroxycoprostane

The XLogP value of 6.7 indicates that Trihydroxycoprostane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Trihydroxycoprostane. Following Lipinski's Rule of Five, Trihydroxycoprostane has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Trihydroxycoprostane?

The CAS number of Trihydroxycoprostane is 547-96-6.

What is the molecular formula of Trihydroxycoprostane?

The molecular formula of Trihydroxycoprostane is C27H48O3.

What is the molecular weight of Trihydroxycoprostane?

The molecular weight of Trihydroxycoprostane is 420.36035 g/mol.

What are the applications of Trihydroxycoprostane?

Trihydroxycoprostane 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 Trihydroxycoprostane?

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

Does CoreyChem offer custom synthesis for Trihydroxycoprostane?

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

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