Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene structure

Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene

TL;DR: Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene (CAS 68109-02-4) is a chemical compound with molecular formula C12H12 and molecular weight 156.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene

Also Known As: 1,2,5-Metheno-1H-cyclobuta[de]naphthalene,1a,2,4a,5,7a,7b-hexahydro-, 1,2,5-Metheno-1H-cyclobuta(de)naphthalene, 1a,2,4a,5,7a,7b-hexahydro-, 3b,4,6a,6b-Tetrahydro-1H-1,4,3a-(ethane[1,1,2]triyl)cyclopropa[de]naphthalene

CAS: 68109-02-4
Molecular Formula C12H12
Molecular Weight 156.09 g/mol
LogP 2.3
Topological Polar Surface Area 0.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
Rotatable Bonds 0
Exact Mass 156.0939
Heavy Atoms 12
Complexity 351.0

Chemical Identifiers

CAS Number 68109-02-4
SMILES C1C2C3C=CC4C2C=CC15C3C54
InChIKey WJJRYJUTPMFZJS-UHFFFAOYSA-N

Product Overview

Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene (CAS 68109-02-4), with molecular formula C12H12 and molecular weight 156.09 g/mol. IUPAC: pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene.

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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 Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene

XLogP
2.3
TPSA (Topological Polar Surface Area)
0.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
Rotatable Bonds
0
Heavy Atoms
12
Complexity
351.0
Exact Mass
156.0939
Monoisotopic Mass
156.0939
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 Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene

The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene. With a topological polar surface area (TPSA) of 0.0 Ų, Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene has 0 hydrogen bond donor(s) and 0 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 Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene?

The CAS number of Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene is 68109-02-4.

What is the molecular formula of Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene?

The molecular formula of Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene is C12H12.

What is the molecular weight of Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene?

The molecular weight of Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene is 156.09 g/mol.

Where can I buy Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene?

You can request a quote for Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene?

Yes, KEHONG BIO provides custom synthesis services for Pentacyclo[6.3.1.01,3.02,7.04,9]dodeca-5,10-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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