硫代碳酰氯氟
TL;DR: 硫代碳酰氯氟 (CAS 1495-18-7) is a chemical compound with molecular formula C(=S)(F)Cl and molecular weight 97.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫代碳酰氯氟
chloromethanethioyl fluoride
Also Known As: thiophosgene II, Fluorothiophosgene, Carbonothioic chloride fluoride, Tolylfluanid metabolite, Chlorofluorothiocarbonyl
| Molecular Formula | C(=S)(F)Cl |
|---|---|
| Molecular Weight | 97.94 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 97.93932 |
| Heavy Atoms | 4 |
| Complexity | 35.0 |
Chemical Identifiers
| CAS Number | 1495-18-7 |
|---|---|
| SMILES | C(=S)(F)Cl |
| InChIKey | FBFTTXYJHNXDDZ-UHFFFAOYSA-N |
Product Overview
硫代碳酰氯氟 (CAS 1495-18-7), with molecular formula C(=S)(F)Cl and molecular weight 97.94 g/mol. IUPAC: chloromethanethioyl fluoride.
Chemical Property Profile of 硫代碳酰氯氟
Property Insights of 硫代碳酰氯氟
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 硫代碳酰氯氟. With a topological polar surface area (TPSA) of 32.1 Ų, 硫代碳酰氯氟 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 硫代碳酰氯氟 has 0 hydrogen bond donor(s) and 2 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 硫代碳酰氯氟?
The CAS number of 硫代碳酰氯氟 is 1495-18-7.
What is the molecular formula of 硫代碳酰氯氟?
The molecular formula of 硫代碳酰氯氟 is C(=S)(F)Cl.
What is the molecular weight of 硫代碳酰氯氟?
The molecular weight of 硫代碳酰氯氟 is 97.94 g/mol.
Where can I buy 硫代碳酰氯氟?
You can request a quote for 硫代碳酰氯氟 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫代碳酰氯氟?
Yes, KEHONG BIO provides custom synthesis services for 硫代碳酰氯氟 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.