p-Nitro-chlorocinnamic aldehyde
TL;DR: p-Nitro-chlorocinnamic aldehyde (CAS 25035-81-8) is a chemical compound with molecular formula C9H6ClNO3 and molecular weight 211.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(2-chloro-4-nitrophenyl)prop-2-enal
Also Known As: p-nitro-chlorocinnamic aldehyde, 3-(2-chloro-4-nitrophenyl)prop-2-enal, 3-(2-Chloro-4-nitro-phenyl)-propenal, (E)-3-(2-chloro-4-nitrophenyl)prop-2-enal, (E)-3-(2-chloro-4-nitro-phenyl)prop-2-enal
| Molecular Formula | C9H6ClNO3 |
|---|---|
| Molecular Weight | 211.00 g/mol |
| LogP | 2.4603 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.00362 |
| Heavy Atoms | 14 |
| Complexity | 401.04358 |
Chemical Identifiers
| CAS Number | 25035-81-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])Cl)/C=C/C=O |
Product Overview
p-Nitro-chlorocinnamic aldehyde (CAS 25035-81-8), with molecular formula C9H6ClNO3 and molecular weight 211.00 g/mol. IUPAC: (E)-3-(2-chloro-4-nitrophenyl)prop-2-enal.
Chemical Property Profile of p-Nitro-chlorocinnamic aldehyde
Property Insights of p-Nitro-chlorocinnamic aldehyde
The XLogP value of 2.4603 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Nitro-chlorocinnamic aldehyde. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for p-Nitro-chlorocinnamic aldehyde. Following Lipinski's Rule of Five, p-Nitro-chlorocinnamic aldehyde 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 p-Nitro-chlorocinnamic aldehyde?
The CAS number of p-Nitro-chlorocinnamic aldehyde is 25035-81-8.
What is the molecular formula of p-Nitro-chlorocinnamic aldehyde?
The molecular formula of p-Nitro-chlorocinnamic aldehyde is C9H6ClNO3.
What is the molecular weight of p-Nitro-chlorocinnamic aldehyde?
The molecular weight of p-Nitro-chlorocinnamic aldehyde is 211.00 g/mol.
Where can I buy p-Nitro-chlorocinnamic aldehyde?
You can request a quote for p-Nitro-chlorocinnamic aldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Nitro-chlorocinnamic aldehyde?
Yes, KEHONG BIO provides custom synthesis services for p-Nitro-chlorocinnamic aldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.