Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate
TL;DR: Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate (CAS 64046-05-5) is a chemical compound with molecular formula C14H23IN2O2 and molecular weight 378.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(dimethylcarbamoyloxy)phenyl]ethyl-trimethylazanium iodide
Also Known As: Dimethylcarbamic ester of hordenine methiodide, Carbamic acid, N,N-dimethyl-, p-(beta-(trimethylammonio)ethyl)phenyl ester, iodide, Ammonium, (p-(N',N'-dimethylcarbamoyloxy)phenethyl)trimethyl-, iodide, AMMONIUM, (p-HYDROXYPHENETHYL)TRIMETHYL-, IODIDE, DIMETHYLCARBAMATE, Carbamic acid, N,N-dimethyl-, 4-(beta-dimethylaminoethyl)phenyl ester, methiodide
| Molecular Formula | C14H23IN2O2 |
|---|---|
| Molecular Weight | 378.08 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.08044 |
| Heavy Atoms | 19 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 64046-05-5 |
|---|---|
| SMILES | CN(C)C(=O)OC1=CC=C(C=C1)CC[N+](C)(C)C.[I-] |
| InChIKey | WHZMLPCDGFGLPB-UHFFFAOYSA-M |
Product Overview
Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate (CAS 64046-05-5), with molecular formula C14H23IN2O2 and molecular weight 378.08 g/mol. IUPAC: 2-[4-(dimethylcarbamoyloxy)phenyl]ethyl-trimethylazanium iodide.
Chemical Property Profile of Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate
Property Insights of Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate
The XLogP value of -1.0 indicates that Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.5 Ų, Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (p-hydroxyphenethyl)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
Frequently Asked Questions
What is the CAS number of Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate?
The CAS number of Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate is 64046-05-5.
What is the molecular formula of Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate?
The molecular formula of Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate is C14H23IN2O2.
What is the molecular weight of Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate?
The molecular weight of Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate is 378.08 g/mol.
Where can I buy Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate?
You can request a quote for Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (p-hydroxyphenethyl)trimethyl-, iodide, dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.