1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1)
TL;DR: 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) (CAS 878-62-6) is a chemical compound with molecular formula C9H20BrNO3 and molecular weight 269.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(hydroxymethyl)-1,3-dioxan-5-yl]methyl-trimethylazanium bromide
Also Known As: HC 1572, ((5-(Hydroxymethyl)-m-dioxan-5-yl)methyl)trimethylammonium bromide, AMMONIUM, ((5-(HYDROXYMETHYL)-m-DIOXAN-5-YL)METHYL)TRIMETHYL-, BROMIDE, [5-(hydroxymethyl)-1,3-dioxan-5-yl]methyl-trimethylazanium bromide, [5-(hydroxymethyl)-1,3-dioxan-5-yl]-N,N,N-trimethylmethanaminium bromide
| Molecular Formula | C9H20BrNO3 |
|---|---|
| Molecular Weight | 269.06 g/mol |
| LogP | -3.32 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.06265 |
| Heavy Atoms | 14 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 878-62-6 |
|---|---|
| SMILES | C[N+](C)(C)CC1(COCOC1)CO.[Br-] |
| InChIKey | QPZCOIFHUDVBBR-UHFFFAOYSA-M |
Product Overview
1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) (CAS 878-62-6), with molecular formula C9H20BrNO3 and molecular weight 269.06 g/mol. IUPAC: [5-(hydroxymethyl)-1,3-dioxan-5-yl]methyl-trimethylazanium bromide.
Chemical Property Profile of 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1)
Property Insights of 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1)
The XLogP value of -3.32 indicates that 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.7 Ų, 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) 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 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1)?
The CAS number of 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) is 878-62-6.
What is the molecular formula of 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1)?
The molecular formula of 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) is C9H20BrNO3.
What is the molecular weight of 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1)?
The molecular weight of 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) is 269.06 g/mol.
Where can I buy 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1)?
You can request a quote for 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxane-5-methanaminium, 5-(hydroxymethyl)-N,N,N-trimethyl-, bromide (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.