![3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride structure](/static/products/2489/24893-00-3.webp)
3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride
TL;DR: 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride (CAS 24893-00-3) is a chemical compound with molecular formula C16H12FNO4S and molecular weight 333.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride
Also Known As: 3-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride, Benzenesulfonylfluoride, 3-[4-(3-nitrophenyl)-1,3-butadien-1-yl]-
| Molecular Formula | C16H12FNO4S |
|---|---|
| Molecular Weight | 333.05 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 88.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.04712 |
| Heavy Atoms | 23 |
| Complexity | 562.0 |
Chemical Identifiers
| CAS Number | 24893-00-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C=CC=CC2=CC(=CC=C2)S(=O)(=O)F |
| InChIKey | RGYWNPVTWFBQAG-UHFFFAOYSA-N |
Product Overview
3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride (CAS 24893-00-3), with molecular formula C16H12FNO4S and molecular weight 333.05 g/mol. IUPAC: 3-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride.
Chemical Property Profile of 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride
Property Insights of 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride
The XLogP value of 4.4 indicates that 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride. Following Lipinski's Rule of Five, 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride 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 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
The CAS number of 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride is 24893-00-3.
What is the molecular formula of 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
The molecular formula of 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride is C16H12FNO4S.
What is the molecular weight of 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
The molecular weight of 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride is 333.05 g/mol.
Where can I buy 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
You can request a quote for 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(3-Nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.