3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one
TL;DR: 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one (CAS 70259-96-0) is a chemical compound with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylidene-1-(4-nitrophenyl)pyrrolidin-2-one
Also Known As: METHYLENEBUTYROLACTAMS DERIV, 3-methylidene-1-(4-nitrophenyl)pyrrolidin-2-one
| Molecular Formula | C11H10N2O3 |
|---|---|
| Molecular Weight | 218.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.06914 |
| Heavy Atoms | 16 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 70259-96-0 |
|---|---|
| SMILES | C=C1CCN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | VWTCSTOQBLMVNB-UHFFFAOYSA-N |
Product Overview
3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one (CAS 70259-96-0), with molecular formula C11H10N2O3 and molecular weight 218.07 g/mol. IUPAC: 3-methylidene-1-(4-nitrophenyl)pyrrolidin-2-one.
Chemical Property Profile of 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one
Property Insights of 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one. Following Lipinski's Rule of Five, 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one 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 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one?
The CAS number of 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one is 70259-96-0.
What is the molecular formula of 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one?
The molecular formula of 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one is C11H10N2O3.
What is the molecular weight of 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one?
The molecular weight of 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one is 218.07 g/mol.
Where can I buy 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one?
You can request a quote for 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.