RefChem:1070199
TL;DR: RefChem:1070199 (CAS 64051-05-4) is a chemical compound with molecular formula C9H14BrNO and molecular weight 231.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hydroxyphenyl)-trimethylazanium bromide
Also Known As: (4-Hydroxyphenyl)trimethylammonium bromide, Ro 2-2987, (4-hydroxyphenyl)-trimethylazanium bromide, AMMONIUM, (p-HYDROXYPHENYL)TRIMETHYL-, BROMIDE, Benzenaminium, 4-hydroxy-N,N,N-trimethyl-, bromide
| Molecular Formula | C9H14BrNO |
|---|---|
| Molecular Weight | 231.03 g/mol |
| LogP | -1.41 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 231.02588 |
| Heavy Atoms | 12 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 64051-05-4 |
|---|---|
| SMILES | C[N+](C)(C)C1=CC=C(C=C1)O.[Br-] |
| InChIKey | BLTGLBUXRZQJCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:1070199 (CAS 64051-05-4), with molecular formula C9H14BrNO and molecular weight 231.03 g/mol. IUPAC: (4-hydroxyphenyl)-trimethylazanium bromide.
Chemical Property Profile of RefChem:1070199
Property Insights of RefChem:1070199
The XLogP value of -1.41 indicates that RefChem:1070199 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.2 Ų, RefChem:1070199 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1070199 has 1 hydrogen bond donor(s) and 2 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 RefChem:1070199?
The CAS number of RefChem:1070199 is 64051-05-4.
What is the molecular formula of RefChem:1070199?
The molecular formula of RefChem:1070199 is C9H14BrNO.
What is the molecular weight of RefChem:1070199?
The molecular weight of RefChem:1070199 is 231.03 g/mol.
Where can I buy RefChem:1070199?
You can request a quote for RefChem:1070199 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1070199?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1070199 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.