Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate structure

Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate

TL;DR: Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate (CAS 74821-68-4) is a chemical compound with molecular formula C14H18O4 and molecular weight 250.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

dimethyl tricyclo[4.2.2.02,5]dec-9-ene-7,8-dicarboxylate

Also Known As: Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate, (2arH.6acH)-octahydro-3t.6t-etheno-cyclobutabenzene-dicarbox

CAS: 74821-68-4
Molecular Formula C14H18O4
Molecular Weight 250.12 g/mol
LogP 1.8
Topological Polar Surface Area 52.6 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 250.12051
Heavy Atoms 18
Complexity 376.0

Chemical Identifiers

CAS Number 74821-68-4
SMILES COC(=O)C1C2C=CC(C1C(=O)OC)C3C2CC3
InChIKey VTKWZUHHRZVSOJ-UHFFFAOYSA-N

Product Overview

Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate (CAS 74821-68-4), with molecular formula C14H18O4 and molecular weight 250.12 g/mol. IUPAC: dimethyl tricyclo[4.2.2.02,5]dec-9-ene-7,8-dicarboxylate.

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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 Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate

XLogP
1.8
TPSA (Topological Polar Surface Area)
52.6
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
4
Heavy Atoms
18
Complexity
376.0
Exact Mass
250.12051
Monoisotopic Mass
250.12051
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 Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate

The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

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?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?

The CAS number of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate is 74821-68-4.

What is the molecular formula of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?

The molecular formula of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate is C14H18O4.

What is the molecular weight of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?

The molecular weight of Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate is 250.12 g/mol.

Where can I buy Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?

You can request a quote for Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate?

Yes, KEHONG BIO provides custom synthesis services for Dimethyl tricyclo[4.2.2.0~2,5~]dec-9-ene-7,8-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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