Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester
TL;DR: Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester (CAS 1713-97-9) is a chemical compound with molecular formula C10H13Cl2OPS2 and molecular weight 313.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
chloromethyl-(4-chlorophenyl)sulfanyl-propan-2-yloxy-sulfanylidene-λ5-phosphane
Also Known As: 3-Chloro-2-hydroxypropanoic acid, AI3-25831, B 10046, Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester, O-Isopropyl-S-(p-chlorophenyl) chloromethylphosphonodithioate
| Molecular Formula | C10H13Cl2OPS2 |
|---|---|
| Molecular Weight | 313.95 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 66.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.95224 |
| Heavy Atoms | 16 |
| Complexity | 255.0 |
Chemical Identifiers
| CAS Number | 1713-97-9 |
|---|---|
| SMILES | CC(C)OP(=S)(CCl)SC1=CC=C(C=C1)Cl |
| InChIKey | WFQFIEFLHILPBF-UHFFFAOYSA-N |
Product Overview
Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester (CAS 1713-97-9), with molecular formula C10H13Cl2OPS2 and molecular weight 313.95 g/mol. IUPAC: chloromethyl-(4-chlorophenyl)sulfanyl-propan-2-yloxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester
Property Insights of Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester
The XLogP value of 5.3 indicates that Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester. Following Lipinski's Rule of Five, Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester?
The CAS number of Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester is 1713-97-9.
What is the molecular formula of Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester?
The molecular formula of Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester is C10H13Cl2OPS2.
What is the molecular weight of Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester?
The molecular weight of Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester is 313.95 g/mol.
Where can I buy Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester?
You can request a quote for Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonodithioic acid, chloromethyl-, S-(p-chlorophenyl) O-isopropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.