N-(2-Chloro-5-nitrobenzylidene)methanamine
TL;DR: N-(2-Chloro-5-nitrobenzylidene)methanamine (CAS 871909-85-2) is a chemical compound with molecular formula C8H7ClN2O2 and molecular weight 198.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloro-5-nitrophenyl)-N-methylmethanimine
Also Known As: N-(2-Chloro-5-nitrobenzylidene)methanamine, N-[(E)-(2-CHLORO-5-NITROPHENYL)METHYLIDENE]-METHANAMINE, 1-(2-chloro-5-nitrophenyl)-N-methylmethanimine, 1174AF, chloronitrophenylmethylidenemethanamine
| Molecular Formula | C8H7ClN2O2 |
|---|---|
| Molecular Weight | 198.02 g/mol |
| LogP | 2.2969 |
| Topological Polar Surface Area | 55.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.0196 |
| Heavy Atoms | 13 |
| Complexity | 363.1617 |
Chemical Identifiers
| CAS Number | 871909-85-2 |
|---|---|
| SMILES | CN=CC1=C(C=CC(=C1)[N+](=O)[O-])Cl |
Product Overview
N-(2-Chloro-5-nitrobenzylidene)methanamine (CAS 871909-85-2), with molecular formula C8H7ClN2O2 and molecular weight 198.02 g/mol. IUPAC: 1-(2-chloro-5-nitrophenyl)-N-methylmethanimine.
Chemical Property Profile of N-(2-Chloro-5-nitrobenzylidene)methanamine
Property Insights of N-(2-Chloro-5-nitrobenzylidene)methanamine
The XLogP value of 2.2969 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Chloro-5-nitrobenzylidene)methanamine. With a topological polar surface area (TPSA) of 55.5 Ų, N-(2-Chloro-5-nitrobenzylidene)methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Chloro-5-nitrobenzylidene)methanamine 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 N-(2-Chloro-5-nitrobenzylidene)methanamine?
The CAS number of N-(2-Chloro-5-nitrobenzylidene)methanamine is 871909-85-2.
What is the molecular formula of N-(2-Chloro-5-nitrobenzylidene)methanamine?
The molecular formula of N-(2-Chloro-5-nitrobenzylidene)methanamine is C8H7ClN2O2.
What is the molecular weight of N-(2-Chloro-5-nitrobenzylidene)methanamine?
The molecular weight of N-(2-Chloro-5-nitrobenzylidene)methanamine is 198.02 g/mol.
Where can I buy N-(2-Chloro-5-nitrobenzylidene)methanamine?
You can request a quote for N-(2-Chloro-5-nitrobenzylidene)methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Chloro-5-nitrobenzylidene)methanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chloro-5-nitrobenzylidene)methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.