N-ethyl-2-nitrobenzamide
TL;DR: N-ethyl-2-nitrobenzamide (CAS 945-23-3) is a chemical compound with molecular formula C9H10N2O3 and molecular weight 194.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-2-nitrobenzamide
Also Known As: N-ethyl-2-nitrobenzamide, benzamide, N-ethyl-2-nitro-, N-ethyl-2-nitro-benzamide, BENZAMIDE,N-ETHYL-2-NITRO-, TIMTEC-BB SBB000327
| Molecular Formula | C9H10N2O3 |
|---|---|
| Molecular Weight | 194.07 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 194.06914 |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 945-23-3 |
|---|---|
| SMILES | CCNC(=O)C1=CC=CC=C1[N+](=O)[O-] |
| InChIKey | MEUCVEVMNSNATL-UHFFFAOYSA-N |
Product Overview
N-ethyl-2-nitrobenzamide (CAS 945-23-3), with molecular formula C9H10N2O3 and molecular weight 194.07 g/mol. IUPAC: N-ethyl-2-nitrobenzamide.
Chemical Property Profile of N-ethyl-2-nitrobenzamide
Property Insights of N-ethyl-2-nitrobenzamide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-ethyl-2-nitrobenzamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-ethyl-2-nitrobenzamide. Following Lipinski's Rule of Five, N-ethyl-2-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
Frequently Asked Questions
What is the CAS number of N-ethyl-2-nitrobenzamide?
The CAS number of N-ethyl-2-nitrobenzamide is 945-23-3.
What is the molecular formula of N-ethyl-2-nitrobenzamide?
The molecular formula of N-ethyl-2-nitrobenzamide is C9H10N2O3.
What is the molecular weight of N-ethyl-2-nitrobenzamide?
The molecular weight of N-ethyl-2-nitrobenzamide is 194.07 g/mol.
Where can I buy N-ethyl-2-nitrobenzamide?
You can request a quote for N-ethyl-2-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-ethyl-2-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-ethyl-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.