![2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride structure](/static/products/3136/31368-36-2.webp)
2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride
TL;DR: 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride (CAS 31368-36-2) is a chemical compound with molecular formula C16H11ClFNO4S and molecular weight 367.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride
Also Known As: 2-chloro-4-[(1Z,3E)-4-(3-nitrophenyl)buta-1,3-dienyl]benzene, 2-chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride, Benzenesulfonylfluoride, 2-chloro-4-[4-(3-nitrophenyl)-1,3-butadien-1-yl]-
| Molecular Formula | C16H11ClFNO4S |
|---|---|
| Molecular Weight | 367.01 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 88.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.00815 |
| Heavy Atoms | 24 |
| Complexity | 596.0 |
Chemical Identifiers
| CAS Number | 31368-36-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C=CC=CC2=CC(=C(C=C2)S(=O)(=O)F)Cl |
| InChIKey | TYLHEUZKIPQQER-UHFFFAOYSA-N |
Product Overview
2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride (CAS 31368-36-2), with molecular formula C16H11ClFNO4S and molecular weight 367.01 g/mol. IUPAC: 2-chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride.
Chemical Property Profile of 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride
Property Insights of 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride
The XLogP value of 5.1 indicates that 2-Chloro-4-[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 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride. Following Lipinski's Rule of Five, 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
The CAS number of 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride is 31368-36-2.
What is the molecular formula of 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
The molecular formula of 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride is C16H11ClFNO4S.
What is the molecular weight of 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
The molecular weight of 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride is 367.01 g/mol.
Where can I buy 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
You can request a quote for 2-Chloro-4-[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 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4-[4-(3-nitrophenyl)buta-1,3-dienyl]benzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.