Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-
TL;DR: Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)- (CAS 67828-50-6) is a chemical compound with molecular formula C18H28N2O4 and molecular weight 336.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5-dibutoxy-4-nitrophenyl)pyrrolidine
Also Known As: 1-(2,5-Dibutoxy-4-nitrophenyl)pyrrolidine, N-(2,5-Dibutoxy-4-nitrophenyl)pyrrolidine, Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-, 2,5-Dibutoxy-1-nitro-4-(1-pyrrolidinyl)benzene, 267-272-2
| Molecular Formula | C18H28N2O4 |
|---|---|
| Molecular Weight | 336.20 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 67.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 336.2049 |
| Heavy Atoms | 24 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 67828-50-6 |
|---|---|
| SMILES | CCCCOC1=CC(=C(C=C1N2CCCC2)OCCCC)[N+](=O)[O-] |
| InChIKey | UNMQMJVEAHOWNC-UHFFFAOYSA-N |
Product Overview
Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)- (CAS 67828-50-6), with molecular formula C18H28N2O4 and molecular weight 336.20 g/mol. IUPAC: 1-(2,5-dibutoxy-4-nitrophenyl)pyrrolidine.
Chemical Property Profile of Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-
Property Insights of Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-
The XLogP value of 4.8 indicates that Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-. Following Lipinski's Rule of Five, Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)- has 0 hydrogen bond donor(s) and 5 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 Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-?
The CAS number of Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)- is 67828-50-6.
What is the molecular formula of Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-?
The molecular formula of Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)- is C18H28N2O4.
What is the molecular weight of Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-?
The molecular weight of Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)- is 336.20 g/mol.
Where can I buy Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-?
You can request a quote for Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Pyrrolidine, 1-(2,5-dibutoxy-4-nitrophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.