2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride
TL;DR: 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride (CAS 93839-69-1) is a chemical compound with molecular formula C8H10Cl2N2O2 and molecular weight 236.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloro-6-nitrophenyl)-N-methylmethanamine;hydrochloride
Also Known As: EINECS 298-840-8, 2-Chloro-N-methyl-6-nitrobenzylamine HCl, 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride, 2-chloro-n-methyl-6-nitrobenzylamine hydrochloride, Benzenemethanamine, 2-chloro-N-methyl-6-nitro-, hydrochloride (1:1)
| Molecular Formula | C8H10Cl2N2O2 |
|---|---|
| Molecular Weight | 236.01 g/mol |
| LogP | 2.3894 |
| Topological Polar Surface Area | 55.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 236.01193 |
| Heavy Atoms | 14 |
| Complexity | 331.11737 |
Chemical Identifiers
| CAS Number | 93839-69-1 |
|---|---|
| SMILES | CNCC1=C(C=CC=C1Cl)[N+](=O)[O-].Cl |
Product Overview
2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride (CAS 93839-69-1), with molecular formula C8H10Cl2N2O2 and molecular weight 236.01 g/mol. IUPAC: 1-(2-chloro-6-nitrophenyl)-N-methylmethanamine;hydrochloride.
Chemical Property Profile of 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride
Property Insights of 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride
The XLogP value of 2.3894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride. With a topological polar surface area (TPSA) of 55.17 Ų, 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride 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 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride?
The CAS number of 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride is 93839-69-1.
What is the molecular formula of 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride?
The molecular formula of 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride is C8H10Cl2N2O2.
What is the molecular weight of 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride?
The molecular weight of 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride is 236.01 g/mol.
Where can I buy 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride?
You can request a quote for 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-N-methyl-6-nitrobenzylamine monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.