Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl
TL;DR: Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl (CAS 118116-09-9) is a chemical compound with molecular formula C19H31ClN2O3 and molecular weight 370.20233 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-tert-butyl-3-(2-pyrrolidin-1-ylethoxy)phenyl] N,N-dimethylcarbamate;hydrochloride
Also Known As: Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl, Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester, monohydrochloride, [4-tert-butyl-3-(2-pyrrolidin-1-ylethoxy)phenyl] N,N-dimethylcarbamate hydrochloride, 4-tert-Butyl-3-[2-(pyrrolidin-1-yl)ethoxy]phenyl dimethylcarbamate--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C19H31ClN2O3 |
| Molecular Weight | 370.20233 g/mol |
| XLogP | 3.9409 |
| Topological Polar Surface Area (TPSA) | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 370.20233 Da |
| Heavy Atoms | 25 |
| Complexity | 400.0 |
| SMILES | CC(C)(C)C1=C(C=C(C=C1)OC(=O)N(C)C)OCCN2CCCC2.Cl |
| InChIKey | HNQRBOWIJABYHP-UHFFFAOYSA-N |
Chemical Property Profile of Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl
Property Insights of Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl
The XLogP value of 3.9409 indicates that Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl has 1 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 Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl?
The CAS number of Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl is 118116-09-9.
What is the molecular formula of Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl?
The molecular formula of Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl is C19H31ClN2O3.
What is the molecular weight of Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl?
The molecular weight of Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl is 370.20233 g/mol.
Where can I buy Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl?
You can request a quote for Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl?
Yes, CoreyChem provides custom synthesis services for Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(2-(1-pyrrolidinyl)ethoxy)phenyl ester HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.