2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid
TL;DR: 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid (CAS 70973-01-2) is a chemical compound with molecular formula C11H10N2O5 and molecular weight 250.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-acetamido-3-(4-nitrophenyl)prop-2-enoic acid
Also Known As: 2-(acetylamino)-3-(4-nitrophenyl)acrylic acid, 2-acetamido-3-(4-nitrophenyl)acrylic acid, 2-acetamido-3-(4-nitrophenyl)prop-2-enoic Acid, AB00115628-01, (E)-2-acetamido-3-(4-nitrophenyl)prop-2-enoic acid
| Molecular Formula | C11H10N2O5 |
|---|---|
| Molecular Weight | 250.06 g/mol |
| LogP | 1.1564 |
| Topological Polar Surface Area | 109.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 250.05898 |
| Heavy Atoms | 18 |
| Complexity | 518.74005 |
Chemical Identifiers
| CAS Number | 70973-01-2 |
|---|---|
| SMILES | CC(=O)N/C(=C/C1=CC=C(C=C1)[N+](=O)[O-])/C(=O)O |
Product Overview
2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid (CAS 70973-01-2), with molecular formula C11H10N2O5 and molecular weight 250.06 g/mol. IUPAC: (E)-2-acetamido-3-(4-nitrophenyl)prop-2-enoic acid.
Chemical Property Profile of 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid
Property Insights of 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid
The XLogP value of 1.1564 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid. The TPSA of 109.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid. Following Lipinski's Rule of Five, 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid has 2 hydrogen bond donor(s) and 4 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-(Acetylamino)-3-(4-nitrophenyl)acrylic acid?
The CAS number of 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid is 70973-01-2.
What is the molecular formula of 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid?
The molecular formula of 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid is C11H10N2O5.
What is the molecular weight of 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid?
The molecular weight of 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid is 250.06 g/mol.
Where can I buy 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid?
You can request a quote for 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Acetylamino)-3-(4-nitrophenyl)acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.