Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate
TL;DR: Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate (CAS 64050-93-7) is a chemical compound with molecular formula C14H21ClN2O3 and molecular weight 300.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]-(2-oxopropyl)azanium chloride
Also Known As: Carbamic acid, methyl-, (5-(acetonyldimethylammonio)-o-tolyl) ester, chloride, Ammonium, (3-(methylcarbamoyloxy)-p-tolyl)acetonyldimethyl-, chloride, AMMONIUM, (3-HYDROXY-p-TOLYL)ACETONYLDIMETHYL-, CHLORIDE, METHYLCARBAMATE, Carbamic acid, N-methyl-, 2-methyl-5-dimethylaminophenyl ester, acetonylchloride, Benzenaminium, N,N,4-trimethyl-3-[[(methylamino)carbonyl]oxy]-N-(2-oxopropyl)-, chloride
| Molecular Formula | C14H21ClN2O3 |
|---|---|
| Molecular Weight | 300.12 g/mol |
| LogP | -1.13 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.12408 |
| Heavy Atoms | 20 |
| Complexity | 342.0 |
Chemical Identifiers
| CAS Number | 64050-93-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](C)(C)CC(=O)C)OC(=O)NC.[Cl-] |
| InChIKey | VCHHKWURIICYMK-UHFFFAOYSA-N |
Product Overview
Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate (CAS 64050-93-7), with molecular formula C14H21ClN2O3 and molecular weight 300.12 g/mol. IUPAC: dimethyl-[4-methyl-3-(methylcarbamoyloxy)phenyl]-(2-oxopropyl)azanium chloride.
Chemical Property Profile of Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate
Property Insights of Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate
The XLogP value of -1.13 indicates that Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.4 Ų, Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate has 1 hydrogen bond donor(s) and 4 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, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate?
The CAS number of Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate is 64050-93-7.
What is the molecular formula of Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate?
The molecular formula of Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate is C14H21ClN2O3.
What is the molecular weight of Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate?
The molecular weight of Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate is 300.12 g/mol.
Where can I buy Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate?
You can request a quote for Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, (3-hydroxy-p-tolyl)acetonyldimethyl-, chloride, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.