1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol
TL;DR: 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol (CAS 7501-34-0) is a chemical compound with molecular formula C17H12BrN3O7 and molecular weight 448.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-7-methylnaphthalene;2,4,6-trinitrophenol
Also Known As: 1-bromo-7-methylnaphthalene,2,4,6-trinitrophenol, 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol, 1-bromo-7-methylnaphthalene; 2,4,6-trinitrophenol, 2,4,6-Trinitrophenol--1-bromo-7-methylnaphthalene (1/1)
| Molecular Formula | C17H12BrN3O7 |
|---|---|
| Molecular Weight | 448.99 g/mol |
| LogP | 5.02752 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 448.98587 |
| Heavy Atoms | 28 |
| Complexity | 447.0 |
Chemical Identifiers
| CAS Number | 7501-34-0 |
|---|---|
| SMILES | CC1=CC2=C(C=CC=C2Br)C=C1.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | NYPLBCIOABHIMS-UHFFFAOYSA-N |
Product Overview
1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol (CAS 7501-34-0), with molecular formula C17H12BrN3O7 and molecular weight 448.99 g/mol. IUPAC: 1-bromo-7-methylnaphthalene;2,4,6-trinitrophenol.
Chemical Property Profile of 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol
Property Insights of 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol
The XLogP value of 5.02752 indicates that 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 158.0 Ų indicates high polarity, suggesting 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol?
The CAS number of 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol is 7501-34-0.
What is the molecular formula of 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol?
The molecular formula of 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol is C17H12BrN3O7.
What is the molecular weight of 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol?
The molecular weight of 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol is 448.99 g/mol.
Where can I buy 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol?
You can request a quote for 1-Bromo-7-methylnaphthalene;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 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-7-methylnaphthalene;2,4,6-trinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.