Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate
TL;DR: Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate (CAS 64050-95-9) is a chemical compound with molecular formula C14H21IN2O2 and molecular weight 376.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-methyl-4-(methylcarbamoyloxy)phenyl]-prop-2-enylazanium iodide
Also Known As: Ammonium, (4-methylcarbamoyloxy-o-tolyl)allyldimethyl-, iodide, Carbamic acid, methyl-, (4-allyldimethylammonio)-m-tolyl ester, iodide, AMMONIUM, (4-HYDROXY-o-TOLYL)ALLYLDIMETHYL-, IODIDE, METHYLCARBAMATE, Carbamic acid, N-methyl-, 3-methyl-4-dimethylaminophenyl ester, allyliodide, dimethyl-[2-methyl-4-(methylcarbamoyloxy)phenyl]-prop-2-enylazanium iodide
| Molecular Formula | C14H21IN2O2 |
|---|---|
| Molecular Weight | 376.06 g/mol |
| LogP | -0.53 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 376.0648 |
| Heavy Atoms | 19 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 64050-95-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OC(=O)NC)[N+](C)(C)CC=C.[I-] |
| InChIKey | ACPZWVSHFRXLGQ-UHFFFAOYSA-N |
Product Overview
Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate (CAS 64050-95-9), with molecular formula C14H21IN2O2 and molecular weight 376.06 g/mol. IUPAC: dimethyl-[2-methyl-4-(methylcarbamoyloxy)phenyl]-prop-2-enylazanium iodide.
Chemical Property Profile of Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate
Property Insights of Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate
The XLogP value of -0.53 indicates that Ammonium, (4-hydroxy-o-tolyl)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, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (4-hydroxy-o-tolyl)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, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate?
The CAS number of Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate is 64050-95-9.
What is the molecular formula of Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate?
The molecular formula of Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate is C14H21IN2O2.
What is the molecular weight of Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate?
The molecular weight of Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate is 376.06 g/mol.
Where can I buy Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate?
You can request a quote for Ammonium, (4-hydroxy-o-tolyl)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, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (4-hydroxy-o-tolyl)allyldimethyl-, iodide, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.