![1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene structure](/static/products/619/61994-99-8.png)
1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene
TL;DR: 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene (CAS 61994-99-8) is a chemical compound with molecular formula C17H17ClO3S and molecular weight 336.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene
Also Known As: benzooxazole-2-carbothioyl chloride, 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene, 1-chloro-4-{[4-(4-methylphenoxy)but-2-en-1-yl]sulfonyl}benzene, 1-[4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene
| Molecular Formula | C17H17ClO3S |
|---|---|
| Molecular Weight | 336.06 g/mol |
| LogP | 4.05732 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.0587 |
| Heavy Atoms | 22 |
| Complexity | 732.47845 |
Chemical Identifiers
| CAS Number | 61994-99-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC/C=C/CS(=O)(=O)C2=CC=C(C=C2)Cl |
Product Overview
1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene (CAS 61994-99-8), with molecular formula C17H17ClO3S and molecular weight 336.06 g/mol. IUPAC: 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene.
Chemical Property Profile of 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene
Property Insights of 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene
The XLogP value of 4.05732 indicates that 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene 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 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene?
The CAS number of 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene is 61994-99-8.
What is the molecular formula of 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene?
The molecular formula of 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene is C17H17ClO3S.
What is the molecular weight of 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene?
The molecular weight of 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene is 336.06 g/mol.
Where can I buy 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene?
You can request a quote for 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-[(E)-4-(4-chlorophenyl)sulfonylbut-2-enoxy]-4-methylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.