N1N1-dimethyl-N2-ortho-nitrophenylformamidine
TL;DR: N1N1-dimethyl-N2-ortho-nitrophenylformamidine (CAS 74739-50-7) is a chemical compound with molecular formula C9H11N3O2 and molecular weight 193.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-N'-(2-nitrophenyl)methanimidamide
Also Known As: N1N1-dimethyl-N2-ortho-nitrophenylformamidine, N,N-dimethyl-N'-(2-nitrophenyl)methanimidamide, (E)-N,N-Dimethyl-N'-2-nitrophenylformamidine, (Z)-N,N-Dimethyl-N'-2-nitrophenylformamidine
| Molecular Formula | C9H11N3O2 |
|---|---|
| Molecular Weight | 193.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.08513 |
| Heavy Atoms | 14 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 74739-50-7 |
|---|---|
| SMILES | CN(C)C=NC1=CC=CC=C1[N+](=O)[O-] |
| InChIKey | UBNRMJZJEMXNRG-UHFFFAOYSA-N |
Product Overview
N1N1-dimethyl-N2-ortho-nitrophenylformamidine (CAS 74739-50-7), with molecular formula C9H11N3O2 and molecular weight 193.09 g/mol. IUPAC: N,N-dimethyl-N'-(2-nitrophenyl)methanimidamide.
Chemical Property Profile of N1N1-dimethyl-N2-ortho-nitrophenylformamidine
Property Insights of N1N1-dimethyl-N2-ortho-nitrophenylformamidine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1N1-dimethyl-N2-ortho-nitrophenylformamidine. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N1N1-dimethyl-N2-ortho-nitrophenylformamidine. Following Lipinski's Rule of Five, N1N1-dimethyl-N2-ortho-nitrophenylformamidine 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 N1N1-dimethyl-N2-ortho-nitrophenylformamidine?
The CAS number of N1N1-dimethyl-N2-ortho-nitrophenylformamidine is 74739-50-7.
What is the molecular formula of N1N1-dimethyl-N2-ortho-nitrophenylformamidine?
The molecular formula of N1N1-dimethyl-N2-ortho-nitrophenylformamidine is C9H11N3O2.
What is the molecular weight of N1N1-dimethyl-N2-ortho-nitrophenylformamidine?
The molecular weight of N1N1-dimethyl-N2-ortho-nitrophenylformamidine is 193.09 g/mol.
Where can I buy N1N1-dimethyl-N2-ortho-nitrophenylformamidine?
You can request a quote for N1N1-dimethyl-N2-ortho-nitrophenylformamidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1N1-dimethyl-N2-ortho-nitrophenylformamidine?
Yes, KEHONG BIO provides custom synthesis services for N1N1-dimethyl-N2-ortho-nitrophenylformamidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.