2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone
TL;DR: 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone (CAS 125520-26-5) is a chemical compound with molecular formula C30H14O6 and molecular weight 470.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-bis(1,4-dioxonaphthalen-2-yl)naphthalene-1,4-dione
Also Known As: NCI60_035071, [2,2':3',2''-Ternaphthalene]-1,1',1'',4,4',4''-hexone, 2,3-bis(1,4-dioxonaphthalen-2-yl)naphthalene-1,4-dione, 2,3-bis(1,4-dioxo-2-naphthyl)naphthalene-1,4-dione, 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone
| Molecular Formula | C30H14O6 |
|---|---|
| Molecular Weight | 470.08 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 470.07904 |
| Heavy Atoms | 36 |
| Complexity | 1100.0 |
Chemical Identifiers
| CAS Number | 125520-26-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C=C(C2=O)C3=C(C(=O)C4=CC=CC=C4C3=O)C5=CC(=O)C6=CC=CC=C6C5=O |
| InChIKey | JIVXUZHUGUHWIF-UHFFFAOYSA-N |
Product Overview
2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone (CAS 125520-26-5), with molecular formula C30H14O6 and molecular weight 470.08 g/mol. IUPAC: 2,3-bis(1,4-dioxonaphthalen-2-yl)naphthalene-1,4-dione.
Chemical Property Profile of 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone
Property Insights of 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone
The XLogP value of 3.8 indicates that 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone. Following Lipinski's Rule of Five, 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone?
The CAS number of 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone is 125520-26-5.
What is the molecular formula of 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone?
The molecular formula of 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone is C30H14O6.
What is the molecular weight of 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone?
The molecular weight of 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone is 470.08 g/mol.
Where can I buy 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone?
You can request a quote for 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone?
Yes, KEHONG BIO provides custom synthesis services for 2,2':3',2''-Ternaphthalene-1,1',1'',4,4',4''-hexone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.