N-cyclopropyl-3-methyl-4-nitrobenzamide
TL;DR: N-cyclopropyl-3-methyl-4-nitrobenzamide (CAS 544690-39-3) is a chemical compound with molecular formula C11H12N2O3 and molecular weight 220.0848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-cyclopropyl-3-methyl-4-nitrobenzamide
Also Known As: N-cyclopropyl-3-methyl-4-nitrobenzamide
Technical Specifications
| Molecular Formula | C11H12N2O3 |
| Molecular Weight | 220.0848 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.0848 Da |
| Heavy Atoms | 16 |
| Complexity | 296.0 |
| SMILES | CC1=C(C=CC(=C1)C(=O)NC2CC2)[N+](=O)[O-] |
| InChIKey | WKRBNESJVINTBB-UHFFFAOYSA-N |
Product Description
Applications: N-cyclopropyl-3-methyl-4-nitrobenzamide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
N-cyclopropyl-3-methyl-4-nitrobenzamide is a fine chemical identified by CAS number 544690-39-3 and the molecular formula C11H12N2O3 and a molecular weight of 220.08 g/mol. Synonyms include N-cyclopropyl-3-methyl-4-nitrobenzamide and WKRBNESJVINTBB-UHFFFAOYSA-N.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N-cyclopropyl-3-methyl-4-nitrobenzamide
Property Insights of N-cyclopropyl-3-methyl-4-nitrobenzamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-cyclopropyl-3-methyl-4-nitrobenzamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-cyclopropyl-3-methyl-4-nitrobenzamide. Following Lipinski's Rule of Five, N-cyclopropyl-3-methyl-4-nitrobenzamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-cyclopropyl-3-methyl-4-nitrobenzamide?
The CAS number of N-cyclopropyl-3-methyl-4-nitrobenzamide is 544690-39-3.
What is the molecular formula of N-cyclopropyl-3-methyl-4-nitrobenzamide?
The molecular formula of N-cyclopropyl-3-methyl-4-nitrobenzamide is C11H12N2O3.
What is the molecular weight of N-cyclopropyl-3-methyl-4-nitrobenzamide?
The molecular weight of N-cyclopropyl-3-methyl-4-nitrobenzamide is 220.0848 g/mol.
What are the applications of N-cyclopropyl-3-methyl-4-nitrobenzamide?
N-cyclopropyl-3-methyl-4-nitrobenzamide is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation...
Where can I buy N-cyclopropyl-3-methyl-4-nitrobenzamide?
You can request a quote for N-cyclopropyl-3-methyl-4-nitrobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-cyclopropyl-3-methyl-4-nitrobenzamide?
Yes, CoreyChem provides custom synthesis services for N-cyclopropyl-3-methyl-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.