C9H16ClO2PS
TL;DR: C9H16ClO2PS (CAS 10140-91-7) is a chemical compound with molecular formula C9H16ClO2PS and molecular weight 254.02971 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-4a,8a-dimethyl-2-sulfanylidene-5,6,7,8-tetrahydro-4H-benzo[d][1,3,2]dioxaphosphinine
Also Known As: P-Chloro-5,10-dimethyl-2,4-dioxa-P-thiono-3-phosphabicyclo(4.4.0)decane, 3-Phosphabicyclo(4.4.0)decane, P-chloro-5,10-dimethyl-2,4-dioxa-P-thiono-, P-Chlor-5,10-dimethyl-2,4-dioxa-P-thiono-3-fosfabicyklo(4.4.0)dekan [Czech], 4H-1,3,2-Benzodioxaphosphorin, 2-chlorohexahydro-4,8-dimethyl-, 2-sulfide, P-Chlor-5,10-dimethyl-2,4-dioxa-P-thiono-3-fosfabicyklo(4.4.0)dekan
Technical Specifications
| Molecular Formula | C9H16ClO2PS |
| Molecular Weight | 254.02971 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 254.02971 Da |
| Heavy Atoms | 14 |
| Complexity | 299.0 |
| SMILES | CC12CCCCC1(OP(=S)(OC2)Cl)C |
| InChIKey | HFORSFOJIJJXSO-UHFFFAOYSA-N |
Chemical Property Profile of C9H16ClO2PS
Property Insights of C9H16ClO2PS
The XLogP value of 4.0 indicates that C9H16ClO2PS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, C9H16ClO2PS exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C9H16ClO2PS 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
What is the CAS number of C9H16ClO2PS?
The CAS number of C9H16ClO2PS is 10140-91-7.
What is the molecular formula of C9H16ClO2PS?
The molecular formula of C9H16ClO2PS is C9H16ClO2PS.
What is the molecular weight of C9H16ClO2PS?
The molecular weight of C9H16ClO2PS is 254.02971 g/mol.
Where can I buy C9H16ClO2PS?
You can request a quote for C9H16ClO2PS directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for C9H16ClO2PS?
Yes, CoreyChem provides custom synthesis services for C9H16ClO2PS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.