N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐
TL;DR: N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐 (CAS 10553-04-5) is a chemical compound with molecular formula C11H16N4O7 and molecular weight 316.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐
N-ethyl-N-methylethanamine;2,4,6-trinitrophenol
Also Known As: N-Ethyl-N-methyl-ethanamine, 2-methylbutan-2-amine,2,4,6-trinitrophenol, N-ethyl-N-methylethanamine;2,4,6-trinitrophenol, 2,4,6-trinitrophenol- n-ethyl-n-methylethanamine(1:1), N-ethyl-N-methylethanamine; 2,4,6-trinitrophenol
| Molecular Formula | C11H16N4O7 |
|---|---|
| Molecular Weight | 316.10 g/mol |
| LogP | 2.0748 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 316.1019 |
| Heavy Atoms | 22 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 10553-04-5 |
|---|---|
| SMILES | CCN(C)CC.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | KXSCMTQUPCXYOV-UHFFFAOYSA-N |
Product Overview
N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐 (CAS 10553-04-5), with molecular formula C11H16N4O7 and molecular weight 316.10 g/mol. IUPAC: N-ethyl-N-methylethanamine;2,4,6-trinitrophenol.
Chemical Property Profile of N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐
Property Insights of N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐
The XLogP value of 2.0748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐. The TPSA of 161.0 Ų indicates high polarity, suggesting N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐 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 N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐?
The CAS number of N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐 is 10553-04-5.
What is the molecular formula of N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐?
The molecular formula of N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐 is C11H16N4O7.
What is the molecular weight of N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐?
The molecular weight of N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐 is 316.10 g/mol.
Where can I buy N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐?
You can request a quote for N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐?
Yes, KEHONG BIO provides custom synthesis services for N-乙基-N-甲基乙胺-2,4,6-三硝基苯酚盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.