2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione structure

2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione

TL;DR: 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione (CAS 68160-37-2) is a chemical compound with molecular formula C28H46O4S and molecular weight 478.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione

Also Known As: 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione, 2,4-dione, 2,3-dimethoxy-5-[(3,7,11,15-tetramethyl-2-hexadecenyl)thio]-, 2,3-Dimethoxy-5-{[(2E)-3,7,11,15-tetramethylhexadec-2-en-1-yl]sulfanyl}cyclohexa-2,5-diene-1,4-dione, 2,4-dione, 2,3-dimethoxy-5-[(3,7,11,15-tetramethyl-2-hexadecenyl)thio]-, [R-[R*,R*-(E)]]-

CAS: 68160-37-2
Molecular Formula C28H46O4S
Molecular Weight 478.31 g/mol
LogP 7.6451
Topological Polar Surface Area 52.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 17
Exact Mass 478.31168
Heavy Atoms 33
Complexity 717.409

Chemical Identifiers

CAS Number 68160-37-2
SMILES CC(C)CCCC(C)CCCC(C)CCC/C(=C/CSC1=CC(=O)C(=C(C1=O)OC)OC)/C

Product Overview

2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione (CAS 68160-37-2), with molecular formula C28H46O4S and molecular weight 478.31 g/mol. IUPAC: 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione

XLogP
7.6451
TPSA (Topological Polar Surface Area)
52.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
5
Rotatable Bonds
17
Heavy Atoms
33
Complexity
717.409
Exact Mass
478.31168
Monoisotopic Mass
478.31168
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 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione

The XLogP value of 7.6451 indicates that 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
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Frequently Asked Questions

What is the CAS number of 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione?

The CAS number of 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione is 68160-37-2.

What is the molecular formula of 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione?

The molecular formula of 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione is C28H46O4S.

What is the molecular weight of 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione?

The molecular weight of 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione is 478.31 g/mol.

Where can I buy 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione?

You can request a quote for 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione?

Yes, KEHONG BIO provides custom synthesis services for 2,3-dimethoxy-5-[(E)-3,7,11,15-tetramethylhexadec-2-enyl]sulfanylcyclohexa-2,5-diene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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