Aniline, N-methyl-m-nitro-N-nitroso-
TL;DR: Aniline, N-methyl-m-nitro-N-nitroso- (CAS 18600-50-5) is a chemical compound with molecular formula C7H7N3O3 and molecular weight 181.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-(3-nitrophenyl)nitrous amide
Also Known As: ANILINE, N-METHYL-m-NITRO-N-NITROSO-, N-Methyl-m-nitro-N-nitrosoaniline, N-methyl-N-(3-nitrophenyl)nitrous amide, 4-16-00-00869 (Beilstein Handbook Reference), BRN 1842298
| Molecular Formula | C7H7N3O3 |
|---|---|
| Molecular Weight | 181.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 78.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.04874 |
| Heavy Atoms | 13 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 18600-50-5 |
|---|---|
| SMILES | CN(C1=CC(=CC=C1)[N+](=O)[O-])N=O |
| InChIKey | YDCFMXNFSOCYOU-UHFFFAOYSA-N |
Product Overview
Aniline, N-methyl-m-nitro-N-nitroso- (CAS 18600-50-5), with molecular formula C7H7N3O3 and molecular weight 181.05 g/mol. IUPAC: N-methyl-N-(3-nitrophenyl)nitrous amide.
Chemical Property Profile of Aniline, N-methyl-m-nitro-N-nitroso-
Property Insights of Aniline, N-methyl-m-nitro-N-nitroso-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aniline, N-methyl-m-nitro-N-nitroso-. The TPSA of 78.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Aniline, N-methyl-m-nitro-N-nitroso-. Following Lipinski's Rule of Five, Aniline, N-methyl-m-nitro-N-nitroso- has 0 hydrogen bond donor(s) and 5 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 Aniline, N-methyl-m-nitro-N-nitroso-?
The CAS number of Aniline, N-methyl-m-nitro-N-nitroso- is 18600-50-5.
What is the molecular formula of Aniline, N-methyl-m-nitro-N-nitroso-?
The molecular formula of Aniline, N-methyl-m-nitro-N-nitroso- is C7H7N3O3.
What is the molecular weight of Aniline, N-methyl-m-nitro-N-nitroso-?
The molecular weight of Aniline, N-methyl-m-nitro-N-nitroso- is 181.05 g/mol.
Where can I buy Aniline, N-methyl-m-nitro-N-nitroso-?
You can request a quote for Aniline, N-methyl-m-nitro-N-nitroso- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniline, N-methyl-m-nitro-N-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for Aniline, N-methyl-m-nitro-N-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.