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9,10-Secocholesta-5,7,10-triene-3,25-diol structure
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9,10-Secocholesta-5,7,10-triene-3,25-diol

TL;DR: 9,10-Secocholesta-5,7,10-triene-3,25-diol (CAS 19356-17-3) is a chemical compound with molecular formula C27H44O2 and molecular weight 400.33414 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[2-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol

Also Known As: Calcifediol, Calcifediol-d3, Calcifediolum, Calcifidiol, Hidroferol

CAS Number
19356-17-3
Molecular Formula
C27H44O2
Molecular Weight
400.33414 g/mol
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Technical Specifications

Molecular FormulaC27H44O2
Molecular Weight400.33414 g/mol
XLogP6.2
Topological Polar Surface Area (TPSA)40.5 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds6
Exact Mass400.33414 Da
Heavy Atoms29
Complexity655.0
SMILESCC(CCCC(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C
InChIKeyJWUBBDSIWDLEOM-UHFFFAOYSA-N

Product Description

Applications: 9,10-Secocholesta-5,7,10-triene-3,25-diol 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).

9,10-Secocholesta-5,7,10-triene-3,25-diol (CAS 19356-17-3) is a fine chemical with the molecular formula C27H44O2 and a molecular weight of 400.33 g/mol. Synonyms include Calcifediol and Calcifediol-d3.

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 9,10-Secocholesta-5,7,10-triene-3,25-diol

XLogP
6.2
TPSA (Topological Polar Surface Area)
40.5
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
6
Heavy Atoms
29
Complexity
655.0
Exact Mass
400.33414
Monoisotopic Mass
400.33414
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 9,10-Secocholesta-5,7,10-triene-3,25-diol

The XLogP value of 6.2 indicates that 9,10-Secocholesta-5,7,10-triene-3,25-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, 9,10-Secocholesta-5,7,10-triene-3,25-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,10-Secocholesta-5,7,10-triene-3,25-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 9,10-Secocholesta-5,7,10-triene-3,25-diol?

The CAS number of 9,10-Secocholesta-5,7,10-triene-3,25-diol is 19356-17-3.

What is the molecular formula of 9,10-Secocholesta-5,7,10-triene-3,25-diol?

The molecular formula of 9,10-Secocholesta-5,7,10-triene-3,25-diol is C27H44O2.

What is the molecular weight of 9,10-Secocholesta-5,7,10-triene-3,25-diol?

The molecular weight of 9,10-Secocholesta-5,7,10-triene-3,25-diol is 400.33414 g/mol.

What are the applications of 9,10-Secocholesta-5,7,10-triene-3,25-diol?

9,10-Secocholesta-5,7,10-triene-3,25-diol 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...

Where can I buy 9,10-Secocholesta-5,7,10-triene-3,25-diol?

You can request a quote for 9,10-Secocholesta-5,7,10-triene-3,25-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 9,10-Secocholesta-5,7,10-triene-3,25-diol?

Yes, CoreyChem provides custom synthesis services for 9,10-Secocholesta-5,7,10-triene-3,25-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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