1,3,5-Trinitro-2,4,6-triA currencythylbenzol
TL;DR: 1,3,5-Trinitro-2,4,6-triA currencythylbenzol (CAS 100139-14-8) is a chemical compound with molecular formula C12H15N3O6 and molecular weight 297.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-triethyl-2,4,6-trinitrobenzene
Also Known As: 1,3,5-Triethyl-2,4,6-trinitrobenzol, 1,3,5-triethyl-2,4,6-trinitrobenzene, 1,3,5-triethyl-2,4,6-trinitro-benzene, 1,3,5-Trinitro-2,4,6-triA currencythylbenzol
| Molecular Formula | C12H15N3O6 |
|---|---|
| Molecular Weight | 297.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.0961 |
| Heavy Atoms | 21 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 100139-14-8 |
|---|---|
| SMILES | CCC1=C(C(=C(C(=C1[N+](=O)[O-])CC)[N+](=O)[O-])CC)[N+](=O)[O-] |
| InChIKey | DQYXXGUPFWWQMH-UHFFFAOYSA-N |
Product Overview
1,3,5-Trinitro-2,4,6-triA currencythylbenzol (CAS 100139-14-8), with molecular formula C12H15N3O6 and molecular weight 297.10 g/mol. IUPAC: 1,3,5-triethyl-2,4,6-trinitrobenzene.
Chemical Property Profile of 1,3,5-Trinitro-2,4,6-triA currencythylbenzol
Property Insights of 1,3,5-Trinitro-2,4,6-triA currencythylbenzol
The XLogP value of 3.8 indicates that 1,3,5-Trinitro-2,4,6-triA currencythylbenzol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3,5-Trinitro-2,4,6-triA currencythylbenzol. Following Lipinski's Rule of Five, 1,3,5-Trinitro-2,4,6-triA currencythylbenzol has 0 hydrogen bond donor(s) and 6 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 1,3,5-Trinitro-2,4,6-triA currencythylbenzol?
The CAS number of 1,3,5-Trinitro-2,4,6-triA currencythylbenzol is 100139-14-8.
What is the molecular formula of 1,3,5-Trinitro-2,4,6-triA currencythylbenzol?
The molecular formula of 1,3,5-Trinitro-2,4,6-triA currencythylbenzol is C12H15N3O6.
What is the molecular weight of 1,3,5-Trinitro-2,4,6-triA currencythylbenzol?
The molecular weight of 1,3,5-Trinitro-2,4,6-triA currencythylbenzol is 297.10 g/mol.
Where can I buy 1,3,5-Trinitro-2,4,6-triA currencythylbenzol?
You can request a quote for 1,3,5-Trinitro-2,4,6-triA currencythylbenzol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Trinitro-2,4,6-triA currencythylbenzol?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Trinitro-2,4,6-triA currencythylbenzol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.