Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester
TL;DR: Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester (CAS 29002-32-2) is a chemical compound with molecular formula C19H12Cl2N2O4 and molecular weight 402.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7-nitroquinolin-8-yl) (E)-3-(3,4-dichlorophenyl)-2-methylprop-2-enoate
Also Known As: 3,4-Dichloro-alpha-methylcinnamic acid 7-nitro-8-quinolyl ester, CINNAMIC ACID, 3,4-DICHLORO-alpha-METHYL-, 7-NITRO-8-QUINOLYL ESTER, 2-Propenoic acid, 3-(3,4-dichlorophenyl)-2-methyl-, 7-nitro-8-quinolinyl ester, 7-Nitro-8-quinolinol 2-(3,4-dichlorobenzylidene)propanoate, 7-nitroquinolin-8-yl 3-(3,4-dichlorophenyl)-2-methylprop-2-enoate
| Molecular Formula | C19H12Cl2N2O4 |
|---|---|
| Molecular Weight | 402.02 g/mol |
| LogP | 5.4587 |
| Topological Polar Surface Area | 82.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.01743 |
| Heavy Atoms | 27 |
| Complexity | 1096.2599 |
Chemical Identifiers
| CAS Number | 29002-32-2 |
|---|---|
| SMILES | C/C(=C\C1=CC(=C(C=C1)Cl)Cl)/C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-] |
Product Overview
Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester (CAS 29002-32-2), with molecular formula C19H12Cl2N2O4 and molecular weight 402.02 g/mol. IUPAC: (7-nitroquinolin-8-yl) (E)-3-(3,4-dichlorophenyl)-2-methylprop-2-enoate.
Chemical Property Profile of Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester
Property Insights of Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester
The XLogP value of 5.4587 indicates that Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl 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 Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester. Following Lipinski's Rule of Five, Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl 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 Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester?
The CAS number of Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester is 29002-32-2.
What is the molecular formula of Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester?
The molecular formula of Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester is C19H12Cl2N2O4.
What is the molecular weight of Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester?
The molecular weight of Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester is 402.02 g/mol.
Where can I buy Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester?
You can request a quote for Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cinnamic acid, 3,4-dichloro-alpha-methyl-, 7-nitro-8-quinolyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.