![2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene structure](/static/products/3830/38307-42-5.webp)
2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene
TL;DR: 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene (CAS 38307-42-5) is a chemical compound with molecular formula C9H8N2O4S and molecular weight 240.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dinitro-1-prop-2-enylsulfanylbenzene
Also Known As: 2,4-dinitro-1-prop-2-enylsulfanylbenzene, 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene
| Molecular Formula | C9H8N2O4S |
|---|---|
| Molecular Weight | 240.02 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.02048 |
| Heavy Atoms | 16 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 38307-42-5 |
|---|---|
| SMILES | C=CCSC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | RVMXPXGUEPSEDF-UHFFFAOYSA-N |
Product Overview
2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene (CAS 38307-42-5), with molecular formula C9H8N2O4S and molecular weight 240.02 g/mol. IUPAC: 2,4-dinitro-1-prop-2-enylsulfanylbenzene.
Chemical Property Profile of 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene
Property Insights of 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene. Following Lipinski's Rule of Five, 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene has 0 hydrogen bond donor(s) and 5 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 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene?
The CAS number of 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene is 38307-42-5.
What is the molecular formula of 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene?
The molecular formula of 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene is C9H8N2O4S.
What is the molecular weight of 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene?
The molecular weight of 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene is 240.02 g/mol.
Where can I buy 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene?
You can request a quote for 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dinitro-1-[(prop-2-en-1-yl)sulfanyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.