8-Quinolinol, 7-nitro-, benzoate (ester)
TL;DR: 8-Quinolinol, 7-nitro-, benzoate (ester) (CAS 29006-99-3) is a chemical compound with molecular formula C16H10N2O4 and molecular weight 294.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-nitroquinolin-8-yl) benzoate
Also Known As: 7-Nitro-8-benzoilossichinolina, 7-nitroquinolin-8-yl benzoate, 8-Quinolinol, 7-nitro-, benzoate (ester), 7-Nitro-8-quinolinol benzoate (ester), 7-Nitro-8-benzoilossichinolina [Italian]
| Molecular Formula | C16H10N2O4 |
|---|---|
| Molecular Weight | 294.06 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.06406 |
| Heavy Atoms | 22 |
| Complexity | 417.0 |
Chemical Identifiers
| CAS Number | 29006-99-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-] |
| InChIKey | IPSCMQIWSNSBST-UHFFFAOYSA-N |
Product Overview
8-Quinolinol, 7-nitro-, benzoate (ester) (CAS 29006-99-3), with molecular formula C16H10N2O4 and molecular weight 294.06 g/mol. IUPAC: (7-nitroquinolin-8-yl) benzoate.
Chemical Property Profile of 8-Quinolinol, 7-nitro-, benzoate (ester)
Property Insights of 8-Quinolinol, 7-nitro-, benzoate (ester)
The XLogP value of 3.4 indicates that 8-Quinolinol, 7-nitro-, benzoate (ester) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Quinolinol, 7-nitro-, benzoate (ester). Following Lipinski's Rule of Five, 8-Quinolinol, 7-nitro-, benzoate (ester) 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 8-Quinolinol, 7-nitro-, benzoate (ester)?
The CAS number of 8-Quinolinol, 7-nitro-, benzoate (ester) is 29006-99-3.
What is the molecular formula of 8-Quinolinol, 7-nitro-, benzoate (ester)?
The molecular formula of 8-Quinolinol, 7-nitro-, benzoate (ester) is C16H10N2O4.
What is the molecular weight of 8-Quinolinol, 7-nitro-, benzoate (ester)?
The molecular weight of 8-Quinolinol, 7-nitro-, benzoate (ester) is 294.06 g/mol.
Where can I buy 8-Quinolinol, 7-nitro-, benzoate (ester)?
You can request a quote for 8-Quinolinol, 7-nitro-, benzoate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Quinolinol, 7-nitro-, benzoate (ester)?
Yes, KEHONG BIO provides custom synthesis services for 8-Quinolinol, 7-nitro-, benzoate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.