Neopentyl 4-bromobenzenesulfonate
TL;DR: Neopentyl 4-bromobenzenesulfonate (CAS 14248-15-8) is a chemical compound with molecular formula C11H15BrO3S and molecular weight 305.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethylpropyl 4-bromobenzenesulfonate
Also Known As: Neopentyl 4-bromobenzenesulfonate, 2,2-dimethylpropyl 4-bromobenzenesulfonate, Neopentyl4-bromobenzenesulfonate, 2,2-dimethylpropyl 4-bromobenzene-1-sulfonate, J3.763.785H
| Molecular Formula | C11H15BrO3S |
|---|---|
| Molecular Weight | 305.99 g/mol |
| LogP | 3.2005 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 305.99252 |
| Heavy Atoms | 16 |
| Complexity | 443.11316 |
Chemical Identifiers
| CAS Number | 14248-15-8 |
|---|---|
| SMILES | CC(C)(C)COS(=O)(=O)C1=CC=C(C=C1)Br |
Product Overview
Neopentyl 4-bromobenzenesulfonate (CAS 14248-15-8), with molecular formula C11H15BrO3S and molecular weight 305.99 g/mol. IUPAC: 2,2-dimethylpropyl 4-bromobenzenesulfonate.
Chemical Property Profile of Neopentyl 4-bromobenzenesulfonate
Property Insights of Neopentyl 4-bromobenzenesulfonate
The XLogP value of 3.2005 indicates that Neopentyl 4-bromobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Neopentyl 4-bromobenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Neopentyl 4-bromobenzenesulfonate 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 Neopentyl 4-bromobenzenesulfonate?
The CAS number of Neopentyl 4-bromobenzenesulfonate is 14248-15-8.
What is the molecular formula of Neopentyl 4-bromobenzenesulfonate?
The molecular formula of Neopentyl 4-bromobenzenesulfonate is C11H15BrO3S.
What is the molecular weight of Neopentyl 4-bromobenzenesulfonate?
The molecular weight of Neopentyl 4-bromobenzenesulfonate is 305.99 g/mol.
Where can I buy Neopentyl 4-bromobenzenesulfonate?
You can request a quote for Neopentyl 4-bromobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Neopentyl 4-bromobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Neopentyl 4-bromobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.