Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate
TL;DR: Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate (CAS 1020252-63-4) is a chemical compound with molecular formula C12H12N2O5 and molecular weight 264.07462 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[3-(3-nitrophenyl)prop-2-enoylamino]acetate
Also Known As: methyl 2-[3-(3-nitrophenyl)prop-2-enamido]acetate, Methyl 2-[3-(3-nitrophenyl)prop-2-enoylamino]acetate, METHYL 2-(3-(3-NITROPHENYL)PROP-2-ENOYLAMINO)ACETATE, methyl 2-[(2E)-3-(3-nitrophenyl)prop-2-enamido]acetate, methyl 2-{[(E)-3-(3-nitrophenyl)-2-propenoyl]amino}acetate
Technical Specifications
| Molecular Formula | C12H12N2O5 |
| Molecular Weight | 264.07462 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 264.07462 Da |
| Heavy Atoms | 19 |
| Complexity | 375.0 |
| SMILES | COC(=O)CNC(=O)C=CC1=CC(=CC=C1)[N+](=O)[O-] |
| InChIKey | LYENPTUEHAKQOP-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate
Property Insights of Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate. Following Lipinski's Rule of Five, Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate 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
What is the CAS number of Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate?
The CAS number of Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate is 1020252-63-4.
What is the molecular formula of Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate?
The molecular formula of Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate is C12H12N2O5.
What is the molecular weight of Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate?
The molecular weight of Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate is 264.07462 g/mol.
Where can I buy Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate?
You can request a quote for Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate?
Yes, CoreyChem provides custom synthesis services for Methyl 2-(3-(3-nitrophenyl)prop-2-enoylamino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.