1,2-Dibutoxy-4-nitrobenzene
TL;DR: 1,2-Dibutoxy-4-nitrobenzene (CAS 4956-77-8) is a chemical compound with molecular formula C14H21NO4 and molecular weight 267.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dibutoxy-4-nitrobenzene
Also Known As: 1,2-dibutoxy-4-nitrobenzene, 1,2-dibutoxy-4-nitro-benzene, Benzene,1,2-dibutoxy-4-nitro, Benzene, 1,2-dibutoxy-4-nitro-
| Molecular Formula | C14H21NO4 |
|---|---|
| Molecular Weight | 267.15 g/mol |
| LogP | 3.9526 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 267.14706 |
| Heavy Atoms | 19 |
| Complexity | 406.43246 |
Chemical Identifiers
| CAS Number | 4956-77-8 |
|---|---|
| SMILES | CCCCOC1=C(C=C(C=C1)[N+](=O)[O-])OCCCC |
Product Overview
1,2-Dibutoxy-4-nitrobenzene (CAS 4956-77-8), with molecular formula C14H21NO4 and molecular weight 267.15 g/mol. IUPAC: 1,2-dibutoxy-4-nitrobenzene.
Chemical Property Profile of 1,2-Dibutoxy-4-nitrobenzene
Property Insights of 1,2-Dibutoxy-4-nitrobenzene
The XLogP value of 3.9526 indicates that 1,2-Dibutoxy-4-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dibutoxy-4-nitrobenzene. Following Lipinski's Rule of Five, 1,2-Dibutoxy-4-nitrobenzene has 0 hydrogen bond donor(s) and 4 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 1,2-Dibutoxy-4-nitrobenzene?
The CAS number of 1,2-Dibutoxy-4-nitrobenzene is 4956-77-8.
What is the molecular formula of 1,2-Dibutoxy-4-nitrobenzene?
The molecular formula of 1,2-Dibutoxy-4-nitrobenzene is C14H21NO4.
What is the molecular weight of 1,2-Dibutoxy-4-nitrobenzene?
The molecular weight of 1,2-Dibutoxy-4-nitrobenzene is 267.15 g/mol.
Where can I buy 1,2-Dibutoxy-4-nitrobenzene?
You can request a quote for 1,2-Dibutoxy-4-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dibutoxy-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dibutoxy-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.