Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate
TL;DR: Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate (CAS 63981-80-6) 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.
[2-butyl-4-(dimethylcarbamoyloxy)phenyl]-trimethylazanium iodide
Also Known As: Ammonium, ((4-(N,N-dimethylcarbamoyloxy)-2-butyl)phenyl)trimethyl-, iodide, Carbamic acid, dimethyl-, ((4-trimethylammonio)-3-butyl)phenyl ester, iodide, Carbamic acid, N,N-dimethyl-, 3-butyl-4-dimethylaminophenyl ester, methiodide, AMMONIUM, ((4-HYDROXY-2-BUTYL)PHENYL)TRIMETHYL-, IODIDE, DIMETHYLCARBAMATE, [2-butyl-4-(dimethylcarbamoyloxy)phenyl]-trimethylazanium iodide
Technical Specifications
| Molecular Formula | C16H27IN2O2 |
| Molecular Weight | 406.11172 g/mol |
| XLogP | 0.29 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.11172 Da |
| Heavy Atoms | 21 |
| Complexity | 310.0 |
| SMILES | CCCCC1=C(C=CC(=C1)OC(=O)N(C)C)[N+](C)(C)C.[I-] |
| InChIKey | LJFLKAUDQFIQLV-UHFFFAOYSA-M |
Chemical Property Profile of Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate
Property Insights of Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate
The XLogP value of 0.29 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate. With a topological polar surface area (TPSA) of 29.5 Ų, Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, ((4-hydroxy-2-butyl)phenyl)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, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate?
The CAS number of Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate is 63981-80-6.
What is the molecular formula of Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate?
The molecular formula of Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate is C16H27IN2O2.
What is the molecular weight of Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate?
The molecular weight of Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate is 406.11172 g/mol.
Where can I buy Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate?
You can request a quote for Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate?
Yes, CoreyChem provides custom synthesis services for Ammonium, ((4-hydroxy-2-butyl)phenyl)trimethyl-, iodide, dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.