Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester
TL;DR: Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester (CAS 29002-07-1) is a chemical compound with molecular formula C24H16N2O4 and molecular weight 396.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-nitroquinolin-8-yl) (E)-2,3-diphenylprop-2-enoate
Also Known As: alpha-(Phenylmethylene)benzeneacetic acid 7-nitro-8-quinolinyl ester, 7-Nitro-8-quinolinyl alpha-(phenylmethylene)benzeneacetate, Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester, (7-nitroquinolin-8-yl) (E)-2,3-diphenylprop-2-enoate, RefChem:1078329
| Molecular Formula | C24H16N2O4 |
|---|---|
| Molecular Weight | 396.11 g/mol |
| LogP | 5.2892 |
| Topological Polar Surface Area | 82.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.111 |
| Heavy Atoms | 30 |
| Complexity | 1252.2052 |
Chemical Identifiers
| CAS Number | 29002-07-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C(\C2=CC=CC=C2)/C(=O)OC3=C(C=CC4=C3N=CC=C4)[N+](=O)[O-] |
Product Overview
Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester (CAS 29002-07-1), with molecular formula C24H16N2O4 and molecular weight 396.11 g/mol. IUPAC: (7-nitroquinolin-8-yl) (E)-2,3-diphenylprop-2-enoate.
Chemical Property Profile of Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester
Property Insights of Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester
The XLogP value of 5.2892 indicates that Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.33 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester. Following Lipinski's Rule of Five, Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester 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 Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester?
The CAS number of Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester is 29002-07-1.
What is the molecular formula of Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester?
The molecular formula of Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester is C24H16N2O4.
What is the molecular weight of Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester?
The molecular weight of Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester is 396.11 g/mol.
Where can I buy Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester?
You can request a quote for Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, alpha-(phenylmethylene)-, 7-nitro-8-quinolinyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.