Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane structure

Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane

TL;DR: Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane (CAS 49726-84-3) is a chemical compound with molecular formula C7H17N5O3+2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane

Also Known As: N(O)(O)O.CN12CN3CN(CN(C3)C1)C2, 3,5,7-Triaza-1-azoniatricyclo[3.3.1.13,7]decane, 1-methyl-, nitrate, 3,7-Triaza-1-azoniatricyclo[3.3.1.13,7]decane, 1-methyl-, nitrate

CAS: 49726-84-3
Molecular Formula C7H17N5O3+2
Molecular Weight 219.13 g/mol
LogP -1.3315
Topological Polar Surface Area 70.26 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 0
Exact Mass 219.13313
Heavy Atoms 15
Complexity 232.06706

Chemical Identifiers

CAS Number 49726-84-3
SMILES C[N+]12CN3CN(C1)CN(C3)C2.[N+](=O)(O)O

Product Overview

Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane (CAS 49726-84-3), with molecular formula C7H17N5O3+2 and molecular weight 219.13 g/mol. IUPAC: dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane

XLogP
-1.3315
TPSA (Topological Polar Surface Area)
70.26
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
0
Heavy Atoms
15
Complexity
232.06706
Exact Mass
219.13313
Monoisotopic Mass
219.13313
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane

The XLogP value of -1.3315 indicates that Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.26 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane. Following Lipinski's Rule of Five, Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane?

The CAS number of Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane is 49726-84-3.

What is the molecular formula of Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane?

The molecular formula of Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane is C7H17N5O3+2.

What is the molecular weight of Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane?

The molecular weight of Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane is 219.13 g/mol.

Where can I buy Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane?

You can request a quote for Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane?

Yes, KEHONG BIO provides custom synthesis services for Dihydroxy(oxo)azanium;1-methyl-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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