![2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde structure](/static/products/3598/35985-70-7.webp)
2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde
TL;DR: 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde (CAS 35985-70-7) is a chemical compound with molecular formula C13H8FNO3S and molecular weight 277.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)sulfanyl-5-nitrobenzaldehyde
Also Known As: 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde, 2-(4-Fluorophenylthio)-5-nitrobenzaldehyde, 2-((4-Fluorophenyl)thio)-5-nitrobenzaldehyde, 2-[(4-fluorophenyl)sulfanyl]-5-nitrobenzaldehyde, 2-(4-fluorophenyl)sulfanyl-5-nitrobenzaldehyde
| Molecular Formula | C13H8FNO3S |
|---|---|
| Molecular Weight | 277.02 g/mol |
| LogP | 3.6976 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.0209 |
| Heavy Atoms | 19 |
| Complexity | 628.2855 |
Chemical Identifiers
| CAS Number | 35985-70-7 |
|---|---|
| SMILES | C1=CC(=CC=C1F)SC2=C(C=C(C=C2)[N+](=O)[O-])C=O |
Product Overview
2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde (CAS 35985-70-7), with molecular formula C13H8FNO3S and molecular weight 277.02 g/mol. IUPAC: 2-(4-fluorophenyl)sulfanyl-5-nitrobenzaldehyde.
Chemical Property Profile of 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde
Property Insights of 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde
The XLogP value of 3.6976 indicates that 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde. Following Lipinski's Rule of Five, 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde 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 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde?
The CAS number of 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde is 35985-70-7.
What is the molecular formula of 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde?
The molecular formula of 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde is C13H8FNO3S.
What is the molecular weight of 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde?
The molecular weight of 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde is 277.02 g/mol.
Where can I buy 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde?
You can request a quote for 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Fluorophenyl)sulfanyl]-5-nitrobenzenecarbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.