1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate structure

1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate

TL;DR: 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate (CAS 5127-97-9) is a chemical compound with molecular formula C24H28O8 and molecular weight 444.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

(4,12,13-triacetyloxy-5-pentacyclo[8.6.0.02,9.03,6.011,14]hexadeca-7,15-dienyl) acetate

Also Known As: 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate

CAS: 5127-97-9
Molecular Formula C24H28O8
Molecular Weight 444.18 g/mol
LogP 1.8232
Topological Polar Surface Area 105.2 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 4
Exact Mass 444.1784
Heavy Atoms 32
Complexity 838.96

Chemical Identifiers

CAS Number 5127-97-9
SMILES CC(=O)OC1C2C=CC3C(C2C1OC(=O)C)C4C3C5C(C=C4)C(C5OC(=O)C)OC(=O)C

Product Overview

1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate (CAS 5127-97-9), with molecular formula C24H28O8 and molecular weight 444.18 g/mol. IUPAC: (4,12,13-triacetyloxy-5-pentacyclo[8.6.0.02,9.03,6.011,14]hexadeca-7,15-dienyl) acetate.

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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 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate

XLogP
1.8232
TPSA (Topological Polar Surface Area)
105.2
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
8
Rotatable Bonds
4
Heavy Atoms
32
Complexity
838.96
Exact Mass
444.1784
Monoisotopic Mass
444.1784
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 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate

The XLogP value of 1.8232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate. The TPSA of 105.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate. Following Lipinski's Rule of Five, 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate has 0 hydrogen bond donor(s) and 8 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 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate?

The CAS number of 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate is 5127-97-9.

What is the molecular formula of 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate?

The molecular formula of 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate is C24H28O8.

What is the molecular weight of 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate?

The molecular weight of 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate is 444.18 g/mol.

Where can I buy 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate?

You can request a quote for 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate?

Yes, KEHONG BIO provides custom synthesis services for 1,2,2a,4a,4b,4c,5,6,6a,8a,8b,8c-Dodecahydrodicyclobuta[a,g]biphenylene-1,2,5,6-tetrayl tetraacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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