4-Nitrophenyl p-tolyl disulfide
TL;DR: 4-Nitrophenyl p-tolyl disulfide (CAS 14756-51-5) is a chemical compound with molecular formula C13H11NO2S2 and molecular weight 277.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-[(4-nitrophenyl)disulfanyl]benzene
Also Known As: 4-Nitrophenyl p-tolyl disulfide, 1-methyl-4-[(4-nitrophenyl)disulfanyl]benzene, 4-methylphenyl 4'-nitrophenyl disulfide, Disulfide, 4-methylphenyl 4-nitrophenyl, 668-136-9
| Molecular Formula | C13H11NO2S2 |
|---|---|
| Molecular Weight | 277.02 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.02313 |
| Heavy Atoms | 18 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 14756-51-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SSC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | AVZZJPNRUVUVEE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Nitrophenyl p-tolyl disulfide (CAS 14756-51-5), with molecular formula C13H11NO2S2 and molecular weight 277.02 g/mol. IUPAC: 1-methyl-4-[(4-nitrophenyl)disulfanyl]benzene.
Chemical Property Profile of 4-Nitrophenyl p-tolyl disulfide
Property Insights of 4-Nitrophenyl p-tolyl disulfide
The XLogP value of 4.5 indicates that 4-Nitrophenyl p-tolyl disulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrophenyl p-tolyl disulfide. Following Lipinski's Rule of Five, 4-Nitrophenyl p-tolyl disulfide has 0 hydrogen bond donor(s) and 4 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 4-Nitrophenyl p-tolyl disulfide?
The CAS number of 4-Nitrophenyl p-tolyl disulfide is 14756-51-5.
What is the molecular formula of 4-Nitrophenyl p-tolyl disulfide?
The molecular formula of 4-Nitrophenyl p-tolyl disulfide is C13H11NO2S2.
What is the molecular weight of 4-Nitrophenyl p-tolyl disulfide?
The molecular weight of 4-Nitrophenyl p-tolyl disulfide is 277.02 g/mol.
Where can I buy 4-Nitrophenyl p-tolyl disulfide?
You can request a quote for 4-Nitrophenyl p-tolyl disulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrophenyl p-tolyl disulfide?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrophenyl p-tolyl disulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.