2-(2-Nitrophenyl)acrylaldehyde
TL;DR: 2-(2-Nitrophenyl)acrylaldehyde (CAS 71463-16-6) is a chemical compound with molecular formula C9H7NO3 and molecular weight 177.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitrophenyl)prop-2-enal
Also Known As: 2-(2-Nitrophenyl)acrylaldehyde, 2-(2-nitrophenyl)prop-2-enal, 2-[2-Nitrophenyl]acrolein, 2-(2-NITROPHENYL)PROPENAL, Benzeneacetaldehyde, a-methylene-2-nitro-
| Molecular Formula | C9H7NO3 |
|---|---|
| Molecular Weight | 177.04 g/mol |
| LogP | 1.8069 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 177.04259 |
| Heavy Atoms | 13 |
| Complexity | 370.8775 |
Chemical Identifiers
| CAS Number | 71463-16-6 |
|---|---|
| SMILES | C=C(C=O)C1=CC=CC=C1[N+](=O)[O-] |
Product Overview
2-(2-Nitrophenyl)acrylaldehyde (CAS 71463-16-6), with molecular formula C9H7NO3 and molecular weight 177.04 g/mol. IUPAC: 2-(2-nitrophenyl)prop-2-enal.
Chemical Property Profile of 2-(2-Nitrophenyl)acrylaldehyde
Property Insights of 2-(2-Nitrophenyl)acrylaldehyde
The XLogP value of 1.8069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Nitrophenyl)acrylaldehyde. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Nitrophenyl)acrylaldehyde. Following Lipinski's Rule of Five, 2-(2-Nitrophenyl)acrylaldehyde 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 2-(2-Nitrophenyl)acrylaldehyde?
The CAS number of 2-(2-Nitrophenyl)acrylaldehyde is 71463-16-6.
What is the molecular formula of 2-(2-Nitrophenyl)acrylaldehyde?
The molecular formula of 2-(2-Nitrophenyl)acrylaldehyde is C9H7NO3.
What is the molecular weight of 2-(2-Nitrophenyl)acrylaldehyde?
The molecular weight of 2-(2-Nitrophenyl)acrylaldehyde is 177.04 g/mol.
Where can I buy 2-(2-Nitrophenyl)acrylaldehyde?
You can request a quote for 2-(2-Nitrophenyl)acrylaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Nitrophenyl)acrylaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Nitrophenyl)acrylaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.