Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester
TL;DR: Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester (CAS 65459-11-2) is a chemical compound with molecular formula C8H10BrO3PS and molecular weight 295.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenoxy)-dimethoxy-sulfanylidene-λ5-phosphane
Also Known As: AI3-27931, (4-bromophenoxy)-dimethoxy-sulfanylidene-, Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester, O-4-bromophenyl O,O-dimethyl phosphorothioate, O-(4-Bromophenyl) O,O-dimethyl phosphorothioate
| Molecular Formula | C8H10BrO3PS |
|---|---|
| Molecular Weight | 295.93 g/mol |
| LogP | 3.3452 |
| Topological Polar Surface Area | 27.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.92715 |
| Heavy Atoms | 14 |
| Complexity | 332.94455 |
Chemical Identifiers
| CAS Number | 65459-11-2 |
|---|---|
| SMILES | COP(=S)(OC)OC1=CC=C(C=C1)Br |
Product Overview
Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester (CAS 65459-11-2), with molecular formula C8H10BrO3PS and molecular weight 295.93 g/mol. IUPAC: (4-bromophenoxy)-dimethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester
Property Insights of Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester
The XLogP value of 3.3452 indicates that Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.69 Ų, Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester has 0 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 Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester?
The CAS number of Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester is 65459-11-2.
What is the molecular formula of Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester?
The molecular formula of Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester is C8H10BrO3PS.
What is the molecular weight of Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester?
The molecular weight of Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester is 295.93 g/mol.
Where can I buy Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester?
You can request a quote for Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorothioic acid, O-(4-bromophenyl) O,O-dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.