RefChem:1062057
TL;DR: RefChem:1062057 (CAS 100836-55-3) is a chemical compound with molecular formula C15H23ClN2O2 and molecular weight 298.1448 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-pyrrolidin-1-ium-1-ylethyl N-(1-phenylethyl)carbamate chloride
Also Known As: 2-(Pyrrolidinyl)ethyl (alpha-methylbenzyl)carbamate hydrochloride, 2-pyrrolidin-1-ylethylN-(1-phenylethyl)carbamate, 2-pyrrolidin-1-ium-1-ylethyl N-(1-phenylethyl)carbamate chloride, 2-pyrrolidin-1-ium-1-ylethyl N-(1-phenylethyl)carbamate;chloride, Carbamic acid, (1-phenylethyl)-, 2-(pyrrolidinyl)ethyl ester, hydrochloride
Technical Specifications
| Molecular Formula | C15H23ClN2O2 |
| Molecular Weight | 298.1448 g/mol |
| XLogP | -1.84 |
| Topological Polar Surface Area (TPSA) | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.1448 Da |
| Heavy Atoms | 20 |
| Complexity | 271.0 |
| SMILES | CC(C1=CC=CC=C1)NC(=O)OCC[NH+]2CCCC2.[Cl-] |
| InChIKey | CGEWOWZPTQPWEO-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:1062057
Property Insights of RefChem:1062057
The XLogP value of -1.84 indicates that RefChem:1062057 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.8 Ų, RefChem:1062057 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1062057 has 2 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 RefChem:1062057?
The CAS number of RefChem:1062057 is 100836-55-3.
What is the molecular formula of RefChem:1062057?
The molecular formula of RefChem:1062057 is C15H23ClN2O2.
What is the molecular weight of RefChem:1062057?
The molecular weight of RefChem:1062057 is 298.1448 g/mol.
Where can I buy RefChem:1062057?
You can request a quote for RefChem:1062057 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:1062057?
Yes, CoreyChem provides custom synthesis services for RefChem:1062057 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.