1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene
TL;DR: 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene (CAS 7475-99-2) is a chemical compound with molecular formula C19H16BrN3O6 and molecular weight 461.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-bromopropyl)naphthalene;1,3,5-trinitrobenzene
Also Known As: 1-(2-bromopropyl)naphthalene; 1,3,5-trinitrobenzene, 1-(2-bromopropyl)naphthalene,1,3,5-trinitrobenzene, 1,3,5-Trinitrobenzene--1-(2-bromopropyl)naphthalene (1/1)
| Molecular Formula | C19H16BrN3O6 |
|---|---|
| Molecular Weight | 461.02 g/mol |
| LogP | 5.5769 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 461.02225 |
| Heavy Atoms | 29 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 7475-99-2 |
|---|---|
| SMILES | CC(CC1=CC=CC2=CC=CC=C21)Br.C1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | SBNROVQAUOJDFD-UHFFFAOYSA-N |
Product Overview
1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene (CAS 7475-99-2), with molecular formula C19H16BrN3O6 and molecular weight 461.02 g/mol. IUPAC: 1-(2-bromopropyl)naphthalene;1,3,5-trinitrobenzene.
Chemical Property Profile of 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene
Property Insights of 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene
The XLogP value of 5.5769 indicates that 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene 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-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene. Following Lipinski's Rule of Five, 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene?
The CAS number of 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene is 7475-99-2.
What is the molecular formula of 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene?
The molecular formula of 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene is C19H16BrN3O6.
What is the molecular weight of 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene?
The molecular weight of 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene is 461.02 g/mol.
Where can I buy 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene?
You can request a quote for 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Bromopropyl)naphthalene; 1,3,5-trinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.