![2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide structure](/static/products/132/132100-30-2.webp)
2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide
TL;DR: 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide (CAS 132100-30-2) is a chemical compound with molecular formula C11H10N2O4 and molecular weight 234.06406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(3-nitrophenyl)methylidene]-3-oxobutanamide
Also Known As: 2-(3-nitrophenylmethylene)-3-oxo-butanamide, 2-[(3-nitrophenyl)methylidene]-3-oxo-butanamide, 2-[(3-nitrophenyl)methylidene]-3-oxobutanamide
Technical Specifications
| Molecular Formula | C11H10N2O4 |
| Molecular Weight | 234.06406 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.06406 Da |
| Heavy Atoms | 17 |
| Complexity | 370.0 |
| SMILES | CC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])C(=O)N |
| InChIKey | BUYMKHYTYPQYBI-UHFFFAOYSA-N |
Chemical Property Profile of 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide
Property Insights of 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide. Following Lipinski's Rule of Five, 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide?
The CAS number of 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide is 132100-30-2.
What is the molecular formula of 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide?
The molecular formula of 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide is C11H10N2O4.
What is the molecular weight of 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide?
The molecular weight of 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide is 234.06406 g/mol.
Where can I buy 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide?
You can request a quote for 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide?
Yes, CoreyChem provides custom synthesis services for 2-[(3-Nitrophenyl)methylidene]-3-oxobutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.