氯梭曼
TL;DR: 氯梭曼 (CAS 7040-57-5) is a chemical compound with molecular formula C7H16ClO2P and molecular weight 198.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯梭曼
3-[chloro(methyl)phosphoryl]oxy-2,2-dimethylbutane
Also Known As: Chlorosoman, PICl, Pinacolyl methylphosphonochloridate, O-Pinacolyl methylphosphonochloridate, 1,2,2-Trimethylpropyl methylphosphonochloridate
| Molecular Formula | C7H16ClO2P |
|---|---|
| Molecular Weight | 198.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.05765 |
| Heavy Atoms | 11 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 7040-57-5 |
|---|---|
| SMILES | CC(C(C)(C)C)OP(=O)(C)Cl |
| InChIKey | XVNBZVNXJMOQEX-UHFFFAOYSA-N |
Product Overview
氯梭曼 (CAS 7040-57-5), with molecular formula C7H16ClO2P and molecular weight 198.06 g/mol. IUPAC: 3-[chloro(methyl)phosphoryl]oxy-2,2-dimethylbutane.
Chemical Property Profile of 氯梭曼
Property Insights of 氯梭曼
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氯梭曼. With a topological polar surface area (TPSA) of 26.3 Ų, 氯梭曼 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氯梭曼 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 氯梭曼?
The CAS number of 氯梭曼 is 7040-57-5.
What is the molecular formula of 氯梭曼?
The molecular formula of 氯梭曼 is C7H16ClO2P.
What is the molecular weight of 氯梭曼?
The molecular weight of 氯梭曼 is 198.06 g/mol.
Where can I buy 氯梭曼?
You can request a quote for 氯梭曼 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯梭曼?
Yes, KEHONG BIO provides custom synthesis services for 氯梭曼 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.