![5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] structure](/static/products/6823/68239-08-7.webp)
5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]
TL;DR: 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] (CAS 68239-08-7) is a chemical compound with molecular formula C12H12N2O6 and molecular weight 280.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6-dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]
Also Known As: 5,6-Dinitrospiro(1,3-benzodioxole-2,1'-cyclohexane), 5,6-dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane], Spiro[1,3-benzodioxole-2,1'-cyclohexane], 5,6-dinitro-, Spiro(1,3-benzodioxole-2,1'-cyclohexane), 5,6-dinitro-, 5,6-Dinitrospiro[[1,3]benzodioxole-2,1'-cyclohexane]
| Molecular Formula | C12H12N2O6 |
|---|---|
| Molecular Weight | 280.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 280.06955 |
| Heavy Atoms | 20 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 68239-08-7 |
|---|---|
| SMILES | C1CCC2(CC1)OC3=C(O2)C=C(C(=C3)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | FTOUDLLHVRZGEH-UHFFFAOYSA-N |
Product Overview
5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] (CAS 68239-08-7), with molecular formula C12H12N2O6 and molecular weight 280.07 g/mol. IUPAC: 5,6-dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane].
Chemical Property Profile of 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]
Property Insights of 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]
The XLogP value of 3.0 indicates that 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]. Following Lipinski's Rule of Five, 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] 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 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]?
The CAS number of 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] is 68239-08-7.
What is the molecular formula of 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]?
The molecular formula of 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] is C12H12N2O6.
What is the molecular weight of 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]?
The molecular weight of 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] is 280.07 g/mol.
Where can I buy 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]?
You can request a quote for 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane]?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dinitrospiro[1,3-benzodioxole-2,1'-cyclohexane] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.