Dichloroisothiocyanatophosphine
TL;DR: Dichloroisothiocyanatophosphine (CAS 1858-38-4) is a chemical compound with molecular formula CCl2NOPS and molecular weight 174.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dichlorophosphorylimino(sulfanylidene)methane
Also Known As: Dichloroisothiocyanatophosphine, CCl2NOPS, phosphorisothiocyanatidic dichloride, C-Cl2-N-O-P-S, dichlorophosphorylimino(sulfanylidene)methane
| Molecular Formula | CCl2NOPS |
|---|---|
| Molecular Weight | 174.88 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 61.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.88153 |
| Heavy Atoms | 7 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 1858-38-4 |
|---|---|
| SMILES | C(=NP(=O)(Cl)Cl)=S |
| InChIKey | FKIOCEDPFOZQLW-UHFFFAOYSA-N |
Product Overview
Dichloroisothiocyanatophosphine (CAS 1858-38-4), with molecular formula CCl2NOPS and molecular weight 174.88 g/mol. IUPAC: dichlorophosphorylimino(sulfanylidene)methane.
Chemical Property Profile of Dichloroisothiocyanatophosphine
Property Insights of Dichloroisothiocyanatophosphine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dichloroisothiocyanatophosphine. The TPSA of 61.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Dichloroisothiocyanatophosphine. Following Lipinski's Rule of Five, Dichloroisothiocyanatophosphine has 0 hydrogen bond donor(s) and 3 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 Dichloroisothiocyanatophosphine?
The CAS number of Dichloroisothiocyanatophosphine is 1858-38-4.
What is the molecular formula of Dichloroisothiocyanatophosphine?
The molecular formula of Dichloroisothiocyanatophosphine is CCl2NOPS.
What is the molecular weight of Dichloroisothiocyanatophosphine?
The molecular weight of Dichloroisothiocyanatophosphine is 174.88 g/mol.
Where can I buy Dichloroisothiocyanatophosphine?
You can request a quote for Dichloroisothiocyanatophosphine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dichloroisothiocyanatophosphine?
Yes, KEHONG BIO provides custom synthesis services for Dichloroisothiocyanatophosphine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.