4-Nitro-2',4',5'-triacetoxybiphenyl
TL;DR: 4-Nitro-2',4',5'-triacetoxybiphenyl (CAS 80632-65-1) is a chemical compound with molecular formula C18H15NO8 and molecular weight 373.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,5-diacetyloxy-2-(4-nitrophenyl)phenyl] acetate
Also Known As: 4-NITRO-2',4',5'-TRIACETOXYBIPHENYL, [2,5-diacetyloxy-4-(4-nitrophenyl)phenyl] Acetate, [4,5-diacetyloxy-2-(4-nitrophenyl)phenyl] acetate, 661-608-5, RefChem:525846
| Molecular Formula | C18H15NO8 |
|---|---|
| Molecular Weight | 373.08 g/mol |
| LogP | 3.0377 |
| Topological Polar Surface Area | 122.04 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.07977 |
| Heavy Atoms | 27 |
| Complexity | 917.70404 |
Chemical Identifiers
| CAS Number | 80632-65-1 |
|---|---|
| SMILES | CC(=O)OC1=CC(=C(C=C1C2=CC=C(C=C2)[N+](=O)[O-])OC(=O)C)OC(=O)C |
Product Overview
4-Nitro-2',4',5'-triacetoxybiphenyl (CAS 80632-65-1), with molecular formula C18H15NO8 and molecular weight 373.08 g/mol. IUPAC: [4,5-diacetyloxy-2-(4-nitrophenyl)phenyl] acetate.
Chemical Property Profile of 4-Nitro-2',4',5'-triacetoxybiphenyl
Property Insights of 4-Nitro-2',4',5'-triacetoxybiphenyl
The XLogP value of 3.0377 indicates that 4-Nitro-2',4',5'-triacetoxybiphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitro-2',4',5'-triacetoxybiphenyl. Following Lipinski's Rule of Five, 4-Nitro-2',4',5'-triacetoxybiphenyl 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 4-Nitro-2',4',5'-triacetoxybiphenyl?
The CAS number of 4-Nitro-2',4',5'-triacetoxybiphenyl is 80632-65-1.
What is the molecular formula of 4-Nitro-2',4',5'-triacetoxybiphenyl?
The molecular formula of 4-Nitro-2',4',5'-triacetoxybiphenyl is C18H15NO8.
What is the molecular weight of 4-Nitro-2',4',5'-triacetoxybiphenyl?
The molecular weight of 4-Nitro-2',4',5'-triacetoxybiphenyl is 373.08 g/mol.
Where can I buy 4-Nitro-2',4',5'-triacetoxybiphenyl?
You can request a quote for 4-Nitro-2',4',5'-triacetoxybiphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitro-2',4',5'-triacetoxybiphenyl?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitro-2',4',5'-triacetoxybiphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.