![Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- structure](/static/products/1281/128183-94-8.webp)
Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-
TL;DR: Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- (CAS 128183-94-8) is a chemical compound with molecular formula C14H11NO2S and molecular weight 257.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitro-4-(2-phenylethenylsulfanyl)benzene
Also Known As: p-Nitro-phenylstyrylsulfid, Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-, 1-nitro-4-(2-phenylethenylsulfanyl)benzene, 1-Nitro-4-[(2-phenylethen-1-yl)sulfanyl]benzene
| Molecular Formula | C14H11NO2S |
|---|---|
| Molecular Weight | 257.05 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.05106 |
| Heavy Atoms | 18 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 128183-94-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CSC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | GUSCIMGPTLXFGN-UHFFFAOYSA-N |
Product Overview
Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- (CAS 128183-94-8), with molecular formula C14H11NO2S and molecular weight 257.05 g/mol. IUPAC: 1-nitro-4-(2-phenylethenylsulfanyl)benzene.
Chemical Property Profile of Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-
Property Insights of Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-
The XLogP value of 4.2 indicates that Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-. Following Lipinski's Rule of Five, Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- has 0 hydrogen bond donor(s) and 3 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 Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-?
The CAS number of Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- is 128183-94-8.
What is the molecular formula of Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-?
The molecular formula of Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- is C14H11NO2S.
What is the molecular weight of Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-?
The molecular weight of Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- is 257.05 g/mol.
Where can I buy Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-?
You can request a quote for Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-nitro-4-[(2-phenylethenyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-nitro-4-[(2-phenylethenyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.