Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride
TL;DR: Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride (CAS 118116-16-8) is a chemical compound with molecular formula C22H39ClN2O3 and molecular weight 414.26492 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-tert-butyl-3-[3-(dipropylamino)propoxy]phenyl] N,N-dimethylcarbamate;hydrochloride
Also Known As: Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride, Dimethylcarbamic acid 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester HCl, [4-tert-butyl-3-[3-(dipropylamino)propoxy]phenyl] N,N-dimethylcarbamate hydrochloride, 4-tert-Butyl-3-[3-(dipropylamino)propoxy]phenyl dimethylcarbamate--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C22H39ClN2O3 |
| Molecular Weight | 414.26492 g/mol |
| XLogP | 5.3572 |
| Topological Polar Surface Area (TPSA) | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 414.26492 Da |
| Heavy Atoms | 28 |
| Complexity | 414.0 |
| SMILES | CCCN(CCC)CCCOC1=C(C=CC(=C1)OC(=O)N(C)C)C(C)(C)C.Cl |
| InChIKey | PSMOKMXRNJIRQM-UHFFFAOYSA-N |
Chemical Property Profile of Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride
Property Insights of Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride
The XLogP value of 5.3572 indicates that Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride?
The CAS number of Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride is 118116-16-8.
What is the molecular formula of Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride?
The molecular formula of Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride is C22H39ClN2O3.
What is the molecular weight of Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride?
The molecular weight of Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride is 414.26492 g/mol.
Where can I buy Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride?
You can request a quote for Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride?
Yes, CoreyChem provides custom synthesis services for Carbamic acid, dimethyl-, 4-(1,1-dimethylethyl)-3-(3-(dipropylamino)propoxy)phenyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.