Cyclopentane-1,2-diyl bis(4-nitrobenzoate)
TL;DR: Cyclopentane-1,2-diyl bis(4-nitrobenzoate) (CAS 34267-03-3) is a chemical compound with molecular formula C19H16N2O8 and molecular weight 400.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-nitrobenzoyl)oxycyclopentyl] 4-nitrobenzoate
Also Known As: cyclopentane-1,2-diyl bis(4-nitrobenzoate), 3,7-dioxatricyclo[4.1.0.02,4]heptane, [2-(4-nitrobenzoyl)oxycyclopentyl] 4-nitrobenzoate
| Molecular Formula | C19H16N2O8 |
|---|---|
| Molecular Weight | 400.09 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.09067 |
| Heavy Atoms | 29 |
| Complexity | 573.0 |
Chemical Identifiers
| CAS Number | 34267-03-3 |
|---|---|
| SMILES | C1CC(C(C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | WKLGTEJICMXJTJ-UHFFFAOYSA-N |
Product Overview
Cyclopentane-1,2-diyl bis(4-nitrobenzoate) (CAS 34267-03-3), with molecular formula C19H16N2O8 and molecular weight 400.09 g/mol. IUPAC: [2-(4-nitrobenzoyl)oxycyclopentyl] 4-nitrobenzoate.
Chemical Property Profile of Cyclopentane-1,2-diyl bis(4-nitrobenzoate)
Property Insights of Cyclopentane-1,2-diyl bis(4-nitrobenzoate)
The XLogP value of 4.0 indicates that Cyclopentane-1,2-diyl bis(4-nitrobenzoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting Cyclopentane-1,2-diyl bis(4-nitrobenzoate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cyclopentane-1,2-diyl bis(4-nitrobenzoate) 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
Frequently Asked Questions
What is the CAS number of Cyclopentane-1,2-diyl bis(4-nitrobenzoate)?
The CAS number of Cyclopentane-1,2-diyl bis(4-nitrobenzoate) is 34267-03-3.
What is the molecular formula of Cyclopentane-1,2-diyl bis(4-nitrobenzoate)?
The molecular formula of Cyclopentane-1,2-diyl bis(4-nitrobenzoate) is C19H16N2O8.
What is the molecular weight of Cyclopentane-1,2-diyl bis(4-nitrobenzoate)?
The molecular weight of Cyclopentane-1,2-diyl bis(4-nitrobenzoate) is 400.09 g/mol.
Where can I buy Cyclopentane-1,2-diyl bis(4-nitrobenzoate)?
You can request a quote for Cyclopentane-1,2-diyl bis(4-nitrobenzoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentane-1,2-diyl bis(4-nitrobenzoate)?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentane-1,2-diyl bis(4-nitrobenzoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.