Phenol, 4-trimethylammonio-
TL;DR: Phenol, 4-trimethylammonio- (CAS 13100-87-3) is a chemical compound with molecular formula C9H14NO+ and molecular weight 152.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxyphenyl)-trimethylazanium
Also Known As: NoName_919, phenol, 4-trimethylammonio-, 4-hydroxy-n,n,n-trimethylanilinium, (4-hydroxyphenyl)-trimethylazanium, Ammonium, (p-hydroxyphenyl)trimethyl-, hydroxide, inner salt
| Molecular Formula | C9H14NO+ |
|---|---|
| Molecular Weight | 152.11 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.10754 |
| Heavy Atoms | 11 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 13100-87-3 |
|---|---|
| SMILES | C[N+](C)(C)C1=CC=C(C=C1)O |
| InChIKey | FXKOEYONRSTWCP-UHFFFAOYSA-O |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 4-trimethylammonio- (CAS 13100-87-3), with molecular formula C9H14NO+ and molecular weight 152.11 g/mol. IUPAC: (4-hydroxyphenyl)-trimethylazanium.
Chemical Property Profile of Phenol, 4-trimethylammonio-
Property Insights of Phenol, 4-trimethylammonio-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 4-trimethylammonio-. With a topological polar surface area (TPSA) of 20.2 Ų, Phenol, 4-trimethylammonio- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 4-trimethylammonio- has 1 hydrogen bond donor(s) and 1 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 Phenol, 4-trimethylammonio-?
The CAS number of Phenol, 4-trimethylammonio- is 13100-87-3.
What is the molecular formula of Phenol, 4-trimethylammonio-?
The molecular formula of Phenol, 4-trimethylammonio- is C9H14NO+.
What is the molecular weight of Phenol, 4-trimethylammonio-?
The molecular weight of Phenol, 4-trimethylammonio- is 152.11 g/mol.
Where can I buy Phenol, 4-trimethylammonio-?
You can request a quote for Phenol, 4-trimethylammonio- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 4-trimethylammonio-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 4-trimethylammonio- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.