3-methoxy-N,N-dimethyl-4-nitrosoaniline
TL;DR: 3-methoxy-N,N-dimethyl-4-nitrosoaniline (CAS 7474-80-8) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-N,N-dimethyl-4-nitrosoaniline
Also Known As: 3-methoxy-N,N-dimethyl-4-nitrosoaniline, N,N-Dimethyl-3-methoxy-4-nitrosoaniline, Benzenamine, 3-methoxy-N,N-dimethyl-4-nitroso-, 3-methoxy-N,N-dimethyl-4-nitroso-aniline, RefChem:280466
| Molecular Formula | C9H12N2O2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.08987 |
| Heavy Atoms | 13 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 7474-80-8 |
|---|---|
| SMILES | CN(C)C1=CC(=C(C=C1)N=O)OC |
| InChIKey | BZVCSTOYWYLELJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-methoxy-N,N-dimethyl-4-nitrosoaniline (CAS 7474-80-8), with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol. IUPAC: 3-methoxy-N,N-dimethyl-4-nitrosoaniline.
Chemical Property Profile of 3-methoxy-N,N-dimethyl-4-nitrosoaniline
Property Insights of 3-methoxy-N,N-dimethyl-4-nitrosoaniline
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methoxy-N,N-dimethyl-4-nitrosoaniline. With a topological polar surface area (TPSA) of 41.9 Ų, 3-methoxy-N,N-dimethyl-4-nitrosoaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-methoxy-N,N-dimethyl-4-nitrosoaniline has 0 hydrogen bond donor(s) and 4 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-methoxy-N,N-dimethyl-4-nitrosoaniline?
The CAS number of 3-methoxy-N,N-dimethyl-4-nitrosoaniline is 7474-80-8.
What is the molecular formula of 3-methoxy-N,N-dimethyl-4-nitrosoaniline?
The molecular formula of 3-methoxy-N,N-dimethyl-4-nitrosoaniline is C9H12N2O2.
What is the molecular weight of 3-methoxy-N,N-dimethyl-4-nitrosoaniline?
The molecular weight of 3-methoxy-N,N-dimethyl-4-nitrosoaniline is 180.09 g/mol.
Where can I buy 3-methoxy-N,N-dimethyl-4-nitrosoaniline?
You can request a quote for 3-methoxy-N,N-dimethyl-4-nitrosoaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methoxy-N,N-dimethyl-4-nitrosoaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-methoxy-N,N-dimethyl-4-nitrosoaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.