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2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one structure
Fine Chemical

2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one

TL;DR: 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one (CAS 471-05-6) is a chemical compound with molecular formula C15H22O and molecular weight 218.16707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one

Also Known As: Zerumbone, 2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one, (E,E,E)-2,6,9,9-Tetramethyl-2,6,10-cycloundecatrien-1-one, (2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one, 2,6,10-Cycloundecatrien-1-one,2,6,9,9-tetramethyl-, (2E,6E,10E)-

CAS Number
471-05-6
Molecular Formula
C15H22O
Molecular Weight
218.16707 g/mol
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Technical Specifications

Molecular FormulaC15H22O
Molecular Weight218.16707 g/mol
XLogP3.9
Topological Polar Surface Area (TPSA)17.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds0
Exact Mass218.16707 Da
Heavy Atoms16
Complexity354.0
SMILESCC1=CCC(C=CC(=O)C(=CCC1)C)(C)C
InChIKeyGIHNTRQPEMKFKO-UHFFFAOYSA-N

Product Description

Applications: 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one (CAS 471-05-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one is a fine chemical identified by CAS number 471-05-6 and the molecular formula C15H22O and a molecular weight of 218.17 g/mol. It is also known as Zerumbone and 2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one.

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 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one

XLogP
3.9
TPSA (Topological Polar Surface Area)
17.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
0
Heavy Atoms
16
Complexity
354.0
Exact Mass
218.16707
Monoisotopic Mass
218.16707
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 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one

The XLogP value of 3.9 indicates that 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one?

The CAS number of 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one is 471-05-6.

What is the molecular formula of 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one?

The molecular formula of 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one is C15H22O.

What is the molecular weight of 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one?

The molecular weight of 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one is 218.16707 g/mol.

What are the applications of 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one?

2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one (CAS 471-05-6) with custom synthesis available from...

Where can I buy 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one?

You can request a quote for 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one?

Yes, CoreyChem provides custom synthesis services for 2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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