3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid
TL;DR: 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid (CAS 300541-93-9) is a chemical compound with molecular formula C13H14N2O5 and molecular weight 278.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-morpholin-4-yl-3-nitrophenyl)prop-2-enoic acid
Also Known As: 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid, 3-(4-MORPHOLINO-3-NITROPHENYL)ACRYLIC ACID, 3-(4-Morpholin-4-yl-3-nitrophenyl)acrylic acid, 3-(4-morpholin-4-yl-3-nitrophenyl)prop-2-enoic acid, 3-(4-morpholino-3-nitro-phenyl)prop-2-enoic acid
| Molecular Formula | C13H14N2O5 |
|---|---|
| Molecular Weight | 278.09 g/mol |
| LogP | 1.5292 |
| Topological Polar Surface Area | 92.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.09027 |
| Heavy Atoms | 20 |
| Complexity | 549.69257 |
Chemical Identifiers
| CAS Number | 300541-93-9 |
|---|---|
| SMILES | C1COCCN1C2=C(C=C(C=C2)C=CC(=O)O)[N+](=O)[O-] |
Product Overview
3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid (CAS 300541-93-9), with molecular formula C13H14N2O5 and molecular weight 278.09 g/mol. IUPAC: 3-(4-morpholin-4-yl-3-nitrophenyl)prop-2-enoic acid.
Chemical Property Profile of 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid
Property Insights of 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid
The XLogP value of 1.5292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid. The TPSA of 92.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid. Following Lipinski's Rule of Five, 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid has 1 hydrogen bond donor(s) and 5 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 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid?
The CAS number of 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid is 300541-93-9.
What is the molecular formula of 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid?
The molecular formula of 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid is C13H14N2O5.
What is the molecular weight of 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid?
The molecular weight of 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid is 278.09 g/mol.
Where can I buy 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid?
You can request a quote for 3-[4-(Morpholin-4-yl)-3-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 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(Morpholin-4-yl)-3-nitrophenyl]acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.