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Pregnane-3,20-diol structure
Fine Chemical

Pregnane-3,20-diol

TL;DR: Pregnane-3,20-diol (CAS 80-92-2) is a chemical compound with molecular formula C21H36O2 and molecular weight 320.27155 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

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

Also Known As: pregnanediol, ethylvinylketone, Pregnane-3,20-diol, Pregnandiol [JAN], ALLOPREGNANDIOL

CAS Number
80-92-2
Molecular Formula
C21H36O2
Molecular Weight
320.27155 g/mol
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Technical Specifications

Molecular FormulaC21H36O2
Molecular Weight320.27155 g/mol
XLogP5.2
Topological Polar Surface Area (TPSA)40.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass320.27155 Da
Heavy Atoms23
Complexity463.0
SMILESCC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)O
InChIKeyYWYQTGBBEZQBGO-UHFFFAOYSA-N

Product Description

Applications: Pregnane-3,20-diol is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Pregnane-3,20-diol (CAS 80-92-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A fine chemical supplied by CoreyChem, Pregnane-3,20-diol (CAS 80-92-2) has the molecular formula C21H36O2 and a molecular weight of 320.27 g/mol. It is also known as pregnanediol and ethylvinylketone.

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 Pregnane-3,20-diol

XLogP
5.2
TPSA (Topological Polar Surface Area)
40.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
23
Complexity
463.0
Exact Mass
320.27155
Monoisotopic Mass
320.27155
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 Pregnane-3,20-diol

The XLogP value of 5.2 indicates that Pregnane-3,20-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, Pregnane-3,20-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pregnane-3,20-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Pregnane-3,20-diol?

The CAS number of Pregnane-3,20-diol is 80-92-2.

What is the molecular formula of Pregnane-3,20-diol?

The molecular formula of Pregnane-3,20-diol is C21H36O2.

What is the molecular weight of Pregnane-3,20-diol?

The molecular weight of Pregnane-3,20-diol is 320.27155 g/mol.

What are the applications of Pregnane-3,20-diol?

Pregnane-3,20-diol is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Pregnane-3,20-diol (CAS 80-92-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...

Where can I buy Pregnane-3,20-diol?

You can request a quote for Pregnane-3,20-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Pregnane-3,20-diol?

Yes, CoreyChem provides custom synthesis services for Pregnane-3,20-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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