Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate
TL;DR: Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate (CAS 77967-15-8) is a chemical compound with molecular formula C16H30NO8PS and molecular weight 427.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-di(propan-2-yloxy)phosphoryloxyphenyl]-trimethylazanium;methyl sulfate
Also Known As: Diisopropylphosphostigmine, Ro 3-0411, (m-Hydroxyphenyl)-trimethylammonium methylsulfate diisopropylphosphate, AMMONIUM, (m-HYDROXYPHENYL)TRIMETHYL-, METHYLSULFATE, DIISOPROPYLPHOSPHATE, [3-Di(propan-2-yloxy)phosphoryloxyphenyl]-trimethylazanium; methylsulfate
| Molecular Formula | C16H30NO8PS |
|---|---|
| Molecular Weight | 427.14 g/mol |
| LogP | 3.31 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 427.14297 |
| Heavy Atoms | 27 |
| Complexity | 442.0 |
Chemical Identifiers
| CAS Number | 77967-15-8 |
|---|---|
| SMILES | CC(C)OP(=O)(OC1=CC=CC(=C1)[N+](C)(C)C)OC(C)C.COS(=O)(=O)[O-] |
| InChIKey | OOIWSIHAMHVGIP-UHFFFAOYSA-M |
Product Overview
Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate (CAS 77967-15-8), with molecular formula C16H30NO8PS and molecular weight 427.14 g/mol. IUPAC: [3-di(propan-2-yloxy)phosphoryloxyphenyl]-trimethylazanium;methyl sulfate.
Chemical Property Profile of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate
Property Insights of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate
The XLogP value of 3.31 indicates that Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate. Following Lipinski's Rule of Five, Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate has 0 hydrogen bond donor(s) and 8 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 Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate?
The CAS number of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate is 77967-15-8.
What is the molecular formula of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate?
The molecular formula of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate is C16H30NO8PS.
What is the molecular weight of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate?
The molecular weight of Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate is 427.14 g/mol.
Where can I buy Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate?
You can request a quote for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (m-hydroxyphenyl)trimethyl-, methylsulfate, diisopropylphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.