Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate
TL;DR: Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate (CAS 64046-09-9) is a chemical compound with molecular formula C13H19IN2O2 and molecular weight 362.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[4-(methylcarbamoyloxy)phenyl]-prop-2-enylazanium iodide
Also Known As: Carbamic acid, methyl-, (p-allyldimethylammonio)phenyl ester, Ammonium, ((p-methylcarbamoyloxy)phenyl)allyldimethyl-, iodide, AMMONIUM, (p-HYDROXYPHENYL)ALLYLDIMETHYL-, IODIDE, METHYLCARBAMATE, Carbamic acid, N-methyl-, 4-dimethylaminophenyl ester, allyliodide, dimethyl-[4-(methylcarbamoyloxy)phenyl]-prop-2-enylazanium iodide
| Molecular Formula | C13H19IN2O2 |
|---|---|
| Molecular Weight | 362.05 g/mol |
| LogP | -0.84 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.04913 |
| Heavy Atoms | 18 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 64046-09-9 |
|---|---|
| SMILES | CNC(=O)OC1=CC=C(C=C1)[N+](C)(C)CC=C.[I-] |
| InChIKey | LUNSSLCJQLESJL-UHFFFAOYSA-N |
Product Overview
Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate (CAS 64046-09-9), with molecular formula C13H19IN2O2 and molecular weight 362.05 g/mol. IUPAC: dimethyl-[4-(methylcarbamoyloxy)phenyl]-prop-2-enylazanium iodide.
Chemical Property Profile of Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate
Property Insights of Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate
The XLogP value of -0.84 indicates that Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.3 Ų, Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate has 1 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-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate?
The CAS number of Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate is 64046-09-9.
What is the molecular formula of Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate?
The molecular formula of Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate is C13H19IN2O2.
What is the molecular weight of Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate?
The molecular weight of Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate is 362.05 g/mol.
Where can I buy Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate?
You can request a quote for Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (p-hydroxyphenyl)allyldimethyl-, iodide, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.