Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride
TL;DR: Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride (CAS 60045-70-7) is a chemical compound with molecular formula C17H30ClNO2 and molecular weight 315.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-hydroxyphenyl)-dimethyl-(octoxymethyl)azanium chloride
Also Known As: Dimethyl(m-hydroxyphenyl)octyloxymethylammonium chloride, (3-hydroxyphenyl)-dimethyl-(octoxymethyl)azanium chloride, AMMONIUM, DIMETHYL(m-HYDROXYPHENYL)OCTYLOXYMETHYL-, CHLORIDE, m-hydroxyphenyldimethyloctoxymethylammonium chloride, (3-hydroxyphenyl)-dimethyl-(octoxymethyl)azanium,chloride
| Molecular Formula | C17H30ClNO2 |
|---|---|
| Molecular Weight | 315.20 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 315.1965 |
| Heavy Atoms | 21 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 60045-70-7 |
|---|---|
| SMILES | CCCCCCCCOC[N+](C)(C)C1=CC(=CC=C1)O.[Cl-] |
| InChIKey | MVWDMZYUSFASFH-UHFFFAOYSA-N |
Product Overview
Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride (CAS 60045-70-7), with molecular formula C17H30ClNO2 and molecular weight 315.20 g/mol. IUPAC: (3-hydroxyphenyl)-dimethyl-(octoxymethyl)azanium chloride.
Chemical Property Profile of Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride
Property Insights of Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride. With a topological polar surface area (TPSA) of 29.5 Ų, Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride 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, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride?
The CAS number of Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride is 60045-70-7.
What is the molecular formula of Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride?
The molecular formula of Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride is C17H30ClNO2.
What is the molecular weight of Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride?
The molecular weight of Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride is 315.20 g/mol.
Where can I buy Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride?
You can request a quote for Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Ammonium, dimethyl(m-hydroxyphenyl)octyloxymethyl-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.