2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate
TL;DR: 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate (CAS 101976-63-0) is a chemical compound with molecular formula C10H19ClNO3P and molecular weight 267.0791 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-chloroprop-2-enoxy(propan-2-yloxy)phosphoryl]pyrrolidine
Also Known As: 2-Chloroallyl isopropyl 1-pyrrolidinylphosphonate, (2-Chloroallyl)-isopropyl-1-pyrrolidinylphosphonate, 1-Pyrrolidinylphosphonic acid, O-2-chloroallyl O-isopropyl ester, (2-Chloroallyl)isopropyl=1-pyrrolidinylphosphonate, Phosphonic acid, 1-pyrrolidinyl-, 2-chloroallyl isopropyl ester
Technical Specifications
| Molecular Formula | C10H19ClNO3P |
| Molecular Weight | 267.0791 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 267.0791 Da |
| Heavy Atoms | 16 |
| Complexity | 290.0 |
| SMILES | CC(C)OP(=O)(N1CCCC1)OCC(=C)Cl |
| InChIKey | UAWODGDRUIOUKA-UHFFFAOYSA-N |
Chemical Property Profile of 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate
Property Insights of 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate. With a topological polar surface area (TPSA) of 38.8 Ų, 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate?
The CAS number of 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate is 101976-63-0.
What is the molecular formula of 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate?
The molecular formula of 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate is C10H19ClNO3P.
What is the molecular weight of 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate?
The molecular weight of 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate is 267.0791 g/mol.
Where can I buy 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate?
You can request a quote for 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate?
Yes, CoreyChem provides custom synthesis services for 2-Chloroprop-2-en-1-yl propan-2-yl pyrrolidin-1-ylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.