Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride
TL;DR: Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride (CAS 100836-72-4) is a chemical compound with molecular formula C14H20Cl2N2O2 and molecular weight 318.09018 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-chlorophenyl)methyl N-(2-pyrrolidin-1-ium-1-ylethyl)carbamate chloride
Also Known As: o-Chlorobenzyl N-(2-pyrrolidinylethyl)carbamate hydrochloride, CARBAMIC ACID, (2-PYRROLIDINYLETHYL)-, o-CHLOROBENZYL ESTER, MONOHYDROCHLORIDE, (2-chlorophenyl)methyl N-(2-pyrrolidin-1-ium-1-ylethyl)carbamate chloride, 1-[2-({[(2-chlorobenzyl)oxy]carbonyl}amino)ethyl]pyrrolidinium chloride
Technical Specifications
| Molecular Formula | C14H20Cl2N2O2 |
| Molecular Weight | 318.09018 g/mol |
| XLogP | -1.75 |
| Topological Polar Surface Area (TPSA) | 42.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 318.09018 Da |
| Heavy Atoms | 20 |
| Complexity | 283.0 |
| SMILES | C1CC[NH+](C1)CCNC(=O)OCC2=CC=CC=C2Cl.[Cl-] |
| InChIKey | KPIHVOXCCRMPFL-UHFFFAOYSA-N |
Chemical Property Profile of Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride
Property Insights of Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride
The XLogP value of -1.75 indicates that Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride 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, Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride 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 Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride?
The CAS number of Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride is 100836-72-4.
What is the molecular formula of Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride?
The molecular formula of Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride is C14H20Cl2N2O2.
What is the molecular weight of Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride?
The molecular weight of Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride is 318.09018 g/mol.
Where can I buy Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride?
You can request a quote for Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride?
Yes, CoreyChem provides custom synthesis services for Carbamic acid, (2-pyrrolidinylethyl)-, o-chlorobenzyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.