2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol
TL;DR: 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol (CAS 93176-00-2) is a chemical compound with molecular formula C14H22N4O7 and molecular weight 358.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol
Also Known As: 2,4,6-trinitrophenol- 2-ethyl-n,n-dimethylbutan-1-amine(1:1), 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol, 2-ethyl-N,N-dimethylbutan-1-amine; 2,4,6-trinitrophenol, 2,4,6-Trinitrophenol--2-ethyl-N,N-dimethylbutan-1-amine (1/1)
| Molecular Formula | C14H22N4O7 |
|---|---|
| Molecular Weight | 358.15 g/mol |
| LogP | 3.101 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.14883 |
| Heavy Atoms | 25 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 93176-00-2 |
|---|---|
| SMILES | CCC(CC)CN(C)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | COKUJIRFEWWRHG-UHFFFAOYSA-N |
Product Overview
2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol (CAS 93176-00-2), with molecular formula C14H22N4O7 and molecular weight 358.15 g/mol. IUPAC: 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol.
Chemical Property Profile of 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol
Property Insights of 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol
The XLogP value of 3.101 indicates that 2-ethyl-N,N-dimethylbutan-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 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-ethyl-N,N-dimethylbutan-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 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol?
The CAS number of 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol is 93176-00-2.
What is the molecular formula of 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol?
The molecular formula of 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol is C14H22N4O7.
What is the molecular weight of 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol?
The molecular weight of 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol is 358.15 g/mol.
Where can I buy 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol?
You can request a quote for 2-ethyl-N,N-dimethylbutan-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 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-ethyl-N,N-dimethylbutan-1-amine;2,4,6-trinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.