硫酸单戊酯
TL;DR: 硫酸单戊酯 (CAS 110-92-9) is a chemical compound with molecular formula C5H12O4S and molecular weight 168.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫酸单戊酯
pentyl hydrogen sulfate
Also Known As: Monopentyl sulfate, pentyl hydrogen sulfate, Pentyl sulfate, pentylsulfate, Amylosulfuric Acid
| Molecular Formula | C5H12O4S |
|---|---|
| Molecular Weight | 168.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 72.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 168.04562 |
| Heavy Atoms | 10 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 110-92-9 |
|---|---|
| SMILES | CCCCCOS(=O)(=O)O |
| InChIKey | ZIRHAFGGEBQZKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硫酸单戊酯 (CAS 110-92-9), with molecular formula C5H12O4S and molecular weight 168.05 g/mol. IUPAC: pentyl hydrogen sulfate.
Chemical Property Profile of 硫酸单戊酯
Property Insights of 硫酸单戊酯
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硫酸单戊酯. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 硫酸单戊酯. Following Lipinski's Rule of Five, 硫酸单戊酯 has 1 hydrogen bond donor(s) and 4 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 硫酸单戊酯?
The CAS number of 硫酸单戊酯 is 110-92-9.
What is the molecular formula of 硫酸单戊酯?
The molecular formula of 硫酸单戊酯 is C5H12O4S.
What is the molecular weight of 硫酸单戊酯?
The molecular weight of 硫酸单戊酯 is 168.05 g/mol.
Where can I buy 硫酸单戊酯?
You can request a quote for 硫酸单戊酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫酸单戊酯?
Yes, KEHONG BIO provides custom synthesis services for 硫酸单戊酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.