Trimethylamine oxide dihydrate
TL;DR: Trimethylamine oxide dihydrate (CAS 62637-93-8) is a chemical compound with molecular formula C3H13NO3 and molecular weight 111.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethylmethanamine oxide;dihydrate
Also Known As: Trimethylamine N-oxide dihydrate, trimethylamine oxide dihydrate, Trimethylamine-N-oxide dihydrate, TMANO, Trimethylamine oxide, dihydrate
| Molecular Formula | C3H13NO3 |
|---|---|
| Molecular Weight | 111.09 g/mol |
| LogP | -1.459 |
| Topological Polar Surface Area | 20.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 111.08955 |
| Heavy Atoms | 7 |
| Complexity | 28.0 |
Chemical Identifiers
| CAS Number | 62637-93-8 |
|---|---|
| SMILES | C[N+](C)(C)[O-].O.O |
| InChIKey | PGFPZGKEDZGJQZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trimethylamine oxide dihydrate (CAS 62637-93-8), with molecular formula C3H13NO3 and molecular weight 111.09 g/mol. IUPAC: N,N-dimethylmethanamine oxide;dihydrate.
Chemical Property Profile of Trimethylamine oxide dihydrate
Property Insights of Trimethylamine oxide dihydrate
The XLogP value of -1.459 indicates that Trimethylamine oxide dihydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 20.1 Ų, Trimethylamine oxide dihydrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trimethylamine oxide dihydrate has 2 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 Trimethylamine oxide dihydrate?
The CAS number of Trimethylamine oxide dihydrate is 62637-93-8.
What is the molecular formula of Trimethylamine oxide dihydrate?
The molecular formula of Trimethylamine oxide dihydrate is C3H13NO3.
What is the molecular weight of Trimethylamine oxide dihydrate?
The molecular weight of Trimethylamine oxide dihydrate is 111.09 g/mol.
Where can I buy Trimethylamine oxide dihydrate?
You can request a quote for Trimethylamine oxide dihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trimethylamine oxide dihydrate?
Yes, KEHONG BIO provides custom synthesis services for Trimethylamine oxide dihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.