2-Methylpropyl hydrogen sulfate
TL;DR: 2-Methylpropyl hydrogen sulfate (CAS 2412-30-8) is a chemical compound with molecular formula C4H10O4S and molecular weight 154.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-Methylpropyl hydrogen sulfate
2-methylpropyl hydrogen sulfate
Also Known As: Isobutyl sulfate, Isobutylsulfat, 2-methylpropyl hydrogen sulfate, Isobutyl hydrogen sulfate, (2-Methylpropoxy)sulfonic acid
| Molecular Formula | C4H10O4S |
|---|---|
| Molecular Weight | 154.03 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 72.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.02998 |
| Heavy Atoms | 9 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 2412-30-8 |
|---|---|
| SMILES | CC(C)COS(=O)(=O)O |
| InChIKey | JVNPHYVDWYJFES-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methylpropyl hydrogen sulfate (CAS 2412-30-8), with molecular formula C4H10O4S and molecular weight 154.03 g/mol. IUPAC: 2-methylpropyl hydrogen sulfate.
Chemical Property Profile of 2-Methylpropyl hydrogen sulfate
Property Insights of 2-Methylpropyl hydrogen sulfate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylpropyl hydrogen sulfate. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methylpropyl hydrogen sulfate. Following Lipinski's Rule of Five, 2-甲基丙基硫酸氢酯 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 2-甲基丙基硫酸氢酯?
The CAS number of 2-甲基丙基硫酸氢酯 is 2412-30-8.
What is the molecular formula of 2-甲基丙基硫酸氢酯?
The molecular formula of 2-甲基丙基硫酸氢酯 is C4H10O4S.
What is the molecular weight of 2-甲基丙基硫酸氢酯?
The molecular weight of 2-甲基丙基硫酸氢酯 is 154.03 g/mol.
Where can I buy 2-甲基丙基硫酸氢酯?
You can request a quote for 2-甲基丙基硫酸氢酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-甲基丙基硫酸氢酯?
Yes, KEHONG BIO provides custom synthesis services for 2-甲基丙基硫酸氢酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.