2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene
TL;DR: 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene (CAS 27848-30-2) is a chemical compound with molecular formula C13H10N2O5S and molecular weight 306.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-1-nitro-4-(2-nitrophenyl)sulfanylbenzene
Also Known As: methyl 2-nitro-5-[(2-nitrophenyl)thio]phenyl ether, 2-methoxy-1-nitro-4-(2-nitrophenylthio)benzene, 2-methoxy-1-nitro-4-(2-nitrophenyl)sulfanylbenzene, 2-methoxy-1-nitro-4-(2-nitrophenyl)sulfanyl-benzene, 2-METHOXY-1-NITRO-4-[(2-NITROPHENYL)THIO]BENZENE
| Molecular Formula | C13H10N2O5S |
|---|---|
| Molecular Weight | 306.03 g/mol |
| LogP | 3.6628 |
| Topological Polar Surface Area | 95.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.03104 |
| Heavy Atoms | 21 |
| Complexity | 704.711 |
Chemical Identifiers
| CAS Number | 27848-30-2 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)SC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene (CAS 27848-30-2), with molecular formula C13H10N2O5S and molecular weight 306.03 g/mol. IUPAC: 2-methoxy-1-nitro-4-(2-nitrophenyl)sulfanylbenzene.
Chemical Property Profile of 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene
Property Insights of 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene
The XLogP value of 3.6628 indicates that 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene. Following Lipinski's Rule of Five, 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene has 0 hydrogen bond donor(s) and 6 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-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene?
The CAS number of 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene is 27848-30-2.
What is the molecular formula of 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene?
The molecular formula of 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene is C13H10N2O5S.
What is the molecular weight of 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene?
The molecular weight of 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene is 306.03 g/mol.
Where can I buy 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene?
You can request a quote for 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-1-nitro-4-(2-nitrophenylthio)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.