Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate
TL;DR: Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate (CAS 63981-86-2) is a chemical compound with molecular formula C16H27IN2O2 and molecular weight 406.11172 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(dimethylcarbamoyloxy)-2-methyl-5-propan-2-ylphenyl]-trimethylazanium iodide
Also Known As: (5-Hydroxycarvacryl)trimethylammonium iodide, dimethylcarbamate, Ammonium, (5-(N,N-dimethylcarbamoyloxy)carvacryl)trimethyl-, iodide, Carbamic acid, dimethyl-, (6-trimethylammonio)thymyl ester, iodide, Carbamic acid, N,N-dimethyl-, 4-dimethylaminothymyl ester, methiodide, AMMONIUM, (5-HYDROXYCARVACRYL)TRIMETHYL-, IODIDE, DIMETHYLCARBAMATE
Technical Specifications
| Molecular Formula | C16H27IN2O2 |
| Molecular Weight | 406.11172 g/mol |
| XLogP | 0.38 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.11172 Da |
| Heavy Atoms | 21 |
| Complexity | 334.0 |
| SMILES | CC1=C(C=C(C=C1OC(=O)N(C)C)C(C)C)[N+](C)(C)C.[I-] |
| InChIKey | OWBMIRJXYXGPCS-UHFFFAOYSA-M |
Chemical Property Profile of Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate
Property Insights of Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate
The XLogP value of 0.38 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate. With a topological polar surface area (TPSA) of 29.5 Ų, Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate has 0 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 Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate?
The CAS number of Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate is 63981-86-2.
What is the molecular formula of Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate?
The molecular formula of Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate is C16H27IN2O2.
What is the molecular weight of Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate?
The molecular weight of Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate is 406.11172 g/mol.
Where can I buy Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate?
You can request a quote for Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate?
Yes, CoreyChem provides custom synthesis services for Ammonium, (5-hydroxycarvacryl)trimethyl-, iodide, dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.