Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride
TL;DR: Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride (CAS 102281-02-7) is a chemical compound with molecular formula C13H22ClNO2 and molecular weight 259.1339 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)ethyl-methylazanium chloride
Also Known As: Demethyldeacetylthymoxamine hydrochloride, CARVACROL, 3-(2-(METHYLAMINO)ETHOXY)-, HYDROCHLORIDE, 5-Isopropyl-2-methyl-4-methylaminoethoxyphenol hydrochloride, 2-(4-hydroxy-5-methyl-2-propan-2-ylphenoxy)ethyl-methylazanium chloride, 2-[4-hydroxy-5-methyl-2-(propan-2-yl)phenoxy]-n-methylethanaminium chloride
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H22ClNO2 |
| Molecular Weight | 259.1339 g/mol |
| XLogP | -1.6 |
| Topological Polar Surface Area (TPSA) | 46.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 259.1339 Da |
| Heavy Atoms | 17 |
| Complexity | 196.0 |
| SMILES | CC1=CC(=C(C=C1O)C(C)C)OCC[NH2+]C.[Cl-] |
| InChIKey | UMAVFWSONMWVPX-UHFFFAOYSA-N |
Chemical Property Profile of Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride
Property Insights of Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride
The XLogP value of -1.6 indicates that Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.1 Ų, Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride 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 Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride?
The CAS number of Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride is 102281-02-7.
What is the molecular formula of Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride?
The molecular formula of Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride is C13H22ClNO2.
What is the molecular weight of Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride?
The molecular weight of Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride is 259.1339 g/mol.
Where can I buy Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride?
You can request a quote for Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Carvacrol, 3-(2-(methylamino)ethoxy)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.