1-(6-Bromohexoxy)-2-nitrobenzene
TL;DR: 1-(6-Bromohexoxy)-2-nitrobenzene (CAS 118327-51-8) is a chemical compound with molecular formula C12H16BrNO3 and molecular weight 301.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-bromohexoxy)-2-nitrobenzene
Also Known As: 1-(6-bromohexoxy)-2-nitrobenzene, 1-[(6-bromohexyl)oxy]-2-nitro-benzene
| Molecular Formula | C12H16BrNO3 |
|---|---|
| Molecular Weight | 301.03 g/mol |
| LogP | 3.9289 |
| Topological Polar Surface Area | 52.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 301.03137 |
| Heavy Atoms | 17 |
| Complexity | 357.35892 |
Chemical Identifiers
| CAS Number | 118327-51-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)[N+](=O)[O-])OCCCCCCBr |
Product Overview
1-(6-Bromohexoxy)-2-nitrobenzene (CAS 118327-51-8), with molecular formula C12H16BrNO3 and molecular weight 301.03 g/mol. IUPAC: 1-(6-bromohexoxy)-2-nitrobenzene.
Chemical Property Profile of 1-(6-Bromohexoxy)-2-nitrobenzene
Property Insights of 1-(6-Bromohexoxy)-2-nitrobenzene
The XLogP value of 3.9289 indicates that 1-(6-Bromohexoxy)-2-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.37 Ų, 1-(6-Bromohexoxy)-2-nitrobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(6-Bromohexoxy)-2-nitrobenzene has 0 hydrogen bond donor(s) and 3 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-(6-Bromohexoxy)-2-nitrobenzene?
The CAS number of 1-(6-Bromohexoxy)-2-nitrobenzene is 118327-51-8.
What is the molecular formula of 1-(6-Bromohexoxy)-2-nitrobenzene?
The molecular formula of 1-(6-Bromohexoxy)-2-nitrobenzene is C12H16BrNO3.
What is the molecular weight of 1-(6-Bromohexoxy)-2-nitrobenzene?
The molecular weight of 1-(6-Bromohexoxy)-2-nitrobenzene is 301.03 g/mol.
Where can I buy 1-(6-Bromohexoxy)-2-nitrobenzene?
You can request a quote for 1-(6-Bromohexoxy)-2-nitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6-Bromohexoxy)-2-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-Bromohexoxy)-2-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.