1-Methoxypropan-2-yl hydrogen sulfate
TL;DR: 1-Methoxypropan-2-yl hydrogen sulfate (CAS 85684-22-6) is a chemical compound with molecular formula C4H10O5S and molecular weight 170.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxypropan-2-yl hydrogen sulfate
Also Known As: 1-methoxy-2-sulfooxy-propane, 1-methoxypropan-2-yl hydrogen sulfate, 2-Propanol, 1-methoxy-, 2-(hydrogen sulfate), 2-Propanol,1-methoxy-, 2-(hydrogen sulfate), 2-Propanol,1-methoxy-,hydrogen sulfate (9CI)
| Molecular Formula | C4H10O5S |
|---|---|
| Molecular Weight | 170.02 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 81.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.02489 |
| Heavy Atoms | 10 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 85684-22-6 |
|---|---|
| SMILES | CC(COC)OS(=O)(=O)O |
| InChIKey | OTJBFMWZNNEQEW-UHFFFAOYSA-N |
Product Overview
1-Methoxypropan-2-yl hydrogen sulfate (CAS 85684-22-6), with molecular formula C4H10O5S and molecular weight 170.02 g/mol. IUPAC: 1-methoxypropan-2-yl hydrogen sulfate.
Chemical Property Profile of 1-Methoxypropan-2-yl hydrogen sulfate
Property Insights of 1-Methoxypropan-2-yl hydrogen sulfate
The XLogP value of -0.6 indicates that 1-Methoxypropan-2-yl hydrogen sulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methoxypropan-2-yl hydrogen sulfate. Following Lipinski's Rule of Five, 1-Methoxypropan-2-yl hydrogen sulfate has 1 hydrogen bond donor(s) and 5 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-Methoxypropan-2-yl hydrogen sulfate?
The CAS number of 1-Methoxypropan-2-yl hydrogen sulfate is 85684-22-6.
What is the molecular formula of 1-Methoxypropan-2-yl hydrogen sulfate?
The molecular formula of 1-Methoxypropan-2-yl hydrogen sulfate is C4H10O5S.
What is the molecular weight of 1-Methoxypropan-2-yl hydrogen sulfate?
The molecular weight of 1-Methoxypropan-2-yl hydrogen sulfate is 170.02 g/mol.
Where can I buy 1-Methoxypropan-2-yl hydrogen sulfate?
You can request a quote for 1-Methoxypropan-2-yl hydrogen sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxypropan-2-yl hydrogen sulfate?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxypropan-2-yl hydrogen sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.