2-Ethoxy-5-isopropyl-benzenesulfonyl chloride
TL;DR: 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride (CAS 680185-50-6) is a chemical compound with molecular formula C11H15ClO3S and molecular weight 262.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxy-5-propan-2-ylbenzenesulfonyl chloride
Also Known As: 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride, 2-ethoxy-5-propan-2-ylbenzenesulfonyl chloride, 2-Ethoxy-5-isopropylbenzene-1-sulfonyl chloride, 2-ethoxy-5-isopropylphenylsulfonyl chloride, chloro[2-ethoxy-5-(methylethyl)phenyl]sulfone
| Molecular Formula | C11H15ClO3S |
|---|---|
| Molecular Weight | 262.04 g/mol |
| LogP | 3.1362 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.04303 |
| Heavy Atoms | 16 |
| Complexity | 466.11807 |
Chemical Identifiers
| CAS Number | 680185-50-6 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(C)C)S(=O)(=O)Cl |
Product Overview
2-Ethoxy-5-isopropyl-benzenesulfonyl chloride (CAS 680185-50-6), with molecular formula C11H15ClO3S and molecular weight 262.04 g/mol. IUPAC: 2-ethoxy-5-propan-2-ylbenzenesulfonyl chloride.
Chemical Property Profile of 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride
Property Insights of 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride
The XLogP value of 3.1362 indicates that 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride 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 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride?
The CAS number of 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride is 680185-50-6.
What is the molecular formula of 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride?
The molecular formula of 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride is C11H15ClO3S.
What is the molecular weight of 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride?
The molecular weight of 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride is 262.04 g/mol.
Where can I buy 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride?
You can request a quote for 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethoxy-5-isopropyl-benzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.