![1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane structure](/static/products/686/68603-40-7.png)
1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane
TL;DR: 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane (CAS 68603-40-7) is a chemical compound with molecular formula C14H17ClN2O4S and molecular weight 344.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-(2,4-dinitrophenyl)sulfanylcyclooctane
Also Known As: 1-chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane, 1-chloro-2-(2,4-dinitrophenyl)sulfanylcyclooctane, (+-)-(trans-2-Chlor-cyclooctyl)-(2,4-dinitro-phenyl)-sulfid
| Molecular Formula | C14H17ClN2O4S |
|---|---|
| Molecular Weight | 344.06 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 344.05975 |
| Heavy Atoms | 22 |
| Complexity | 401.0 |
Chemical Identifiers
| CAS Number | 68603-40-7 |
|---|---|
| SMILES | C1CCCC(C(CC1)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])Cl |
| InChIKey | ASPCBQHUIMIRPT-UHFFFAOYSA-N |
Product Overview
1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane (CAS 68603-40-7), with molecular formula C14H17ClN2O4S and molecular weight 344.06 g/mol. IUPAC: 1-chloro-2-(2,4-dinitrophenyl)sulfanylcyclooctane.
Chemical Property Profile of 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane
Property Insights of 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane
The XLogP value of 5.1 indicates that 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane. Following Lipinski's Rule of Five, 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane?
The CAS number of 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane is 68603-40-7.
What is the molecular formula of 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane?
The molecular formula of 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane is C14H17ClN2O4S.
What is the molecular weight of 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane?
The molecular weight of 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane is 344.06 g/mol.
Where can I buy 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane?
You can request a quote for 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-2-[(2,4-dinitrophenyl)sulfanyl]cyclooctane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.