3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol
TL;DR: 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol (CAS 7461-56-5) is a chemical compound with molecular formula C14H19ClN4O7 and molecular weight 390.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol
Also Known As: 3-chloro-N,N-dimethylcyclohexan-1-amine; 2,4,6-trinitrophenol, 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol, 2,4,6-Trinitrophenol--3-chloro-N,N-dimethylcyclohexan-1-amine (1/1)
| Molecular Formula | C14H19ClN4O7 |
|---|---|
| Molecular Weight | 390.09 g/mol |
| LogP | 3.2148 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 390.09424 |
| Heavy Atoms | 26 |
| Complexity | 395.0 |
Chemical Identifiers
| CAS Number | 7461-56-5 |
|---|---|
| SMILES | CN(C)C1CCCC(C1)Cl.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | RMCHIIRYNWWPSZ-UHFFFAOYSA-N |
Product Overview
3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol (CAS 7461-56-5), with molecular formula C14H19ClN4O7 and molecular weight 390.09 g/mol. IUPAC: 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol.
Chemical Property Profile of 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol
Property Insights of 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol
The XLogP value of 3.2148 indicates that 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 161.0 Ų indicates high polarity, suggesting 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol has 1 hydrogen bond donor(s) and 8 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-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol?
The CAS number of 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol is 7461-56-5.
What is the molecular formula of 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol?
The molecular formula of 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol is C14H19ClN4O7.
What is the molecular weight of 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol?
The molecular weight of 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol is 390.09 g/mol.
Where can I buy 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol?
You can request a quote for 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N,N-dimethylcyclohexan-1-amine;2,4,6-trinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.