4,5-Bis(hexyloxy)-2-nitrobenzaldehyde
TL;DR: 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde (CAS 80879-55-6) is a chemical compound with molecular formula C19H29NO5 and molecular weight 351.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dihexoxy-2-nitrobenzaldehyde
Also Known As: 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde, EINECS 279-609-0, 4,5-dihexoxy-2-nitrobenzaldehyde, 4,5-bis-(Hexyloxy)-2-nitrobenzaldehyde, Benzaldehyde,4,5-bis(hexyloxy)-2-nitro-
| Molecular Formula | C19H29NO5 |
|---|---|
| Molecular Weight | 351.20 g/mol |
| LogP | 5.3255 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 351.20456 |
| Heavy Atoms | 25 |
| Complexity | 544.86115 |
Chemical Identifiers
| CAS Number | 80879-55-6 |
|---|---|
| SMILES | CCCCCCOC1=C(C=C(C(=C1)C=O)[N+](=O)[O-])OCCCCCC |
Product Overview
4,5-Bis(hexyloxy)-2-nitrobenzaldehyde (CAS 80879-55-6), with molecular formula C19H29NO5 and molecular weight 351.20 g/mol. IUPAC: 4,5-dihexoxy-2-nitrobenzaldehyde.
Chemical Property Profile of 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde
Property Insights of 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde
The XLogP value of 5.3255 indicates that 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde. Following Lipinski's Rule of Five, 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde?
The CAS number of 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde is 80879-55-6.
What is the molecular formula of 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde?
The molecular formula of 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde is C19H29NO5.
What is the molecular weight of 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde?
The molecular weight of 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde is 351.20 g/mol.
Where can I buy 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde?
You can request a quote for 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Bis(hexyloxy)-2-nitrobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.