2-Bromoethyl 4-methylbenzene-1-sulfonate
TL;DR: 2-Bromoethyl 4-methylbenzene-1-sulfonate (CAS 19263-21-9) is a chemical compound with molecular formula C9H11BrO3S and molecular weight 277.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromoethyl 4-methylbenzenesulfonate
Also Known As: 2-bromoethyl 4-methylbenzenesulfonate, bromoethyltriflate, 2-BROMOETHYL TOSYLATE, 2-bromoethyl 4-methylbenzene-1-sulfonate, 2-bromoethyl p-toluenesulfonate
| Molecular Formula | C9H11BrO3S |
|---|---|
| Molecular Weight | 277.96 g/mol |
| LogP | 2.09522 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.96124 |
| Heavy Atoms | 14 |
| Complexity | 383.023 |
Chemical Identifiers
| CAS Number | 19263-21-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCBr |
Product Overview
2-Bromoethyl 4-methylbenzene-1-sulfonate (CAS 19263-21-9), with molecular formula C9H11BrO3S and molecular weight 277.96 g/mol. IUPAC: 2-bromoethyl 4-methylbenzenesulfonate.
Chemical Property Profile of 2-Bromoethyl 4-methylbenzene-1-sulfonate
Property Insights of 2-Bromoethyl 4-methylbenzene-1-sulfonate
The XLogP value of 2.09522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromoethyl 4-methylbenzene-1-sulfonate. With a topological polar surface area (TPSA) of 43.37 Ų, 2-Bromoethyl 4-methylbenzene-1-sulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromoethyl 4-methylbenzene-1-sulfonate 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-Bromoethyl 4-methylbenzene-1-sulfonate?
The CAS number of 2-Bromoethyl 4-methylbenzene-1-sulfonate is 19263-21-9.
What is the molecular formula of 2-Bromoethyl 4-methylbenzene-1-sulfonate?
The molecular formula of 2-Bromoethyl 4-methylbenzene-1-sulfonate is C9H11BrO3S.
What is the molecular weight of 2-Bromoethyl 4-methylbenzene-1-sulfonate?
The molecular weight of 2-Bromoethyl 4-methylbenzene-1-sulfonate is 277.96 g/mol.
Where can I buy 2-Bromoethyl 4-methylbenzene-1-sulfonate?
You can request a quote for 2-Bromoethyl 4-methylbenzene-1-sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromoethyl 4-methylbenzene-1-sulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromoethyl 4-methylbenzene-1-sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.