1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide
TL;DR: 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide (CAS 78621-01-9) is a chemical compound with molecular formula C19H28INO2 and molecular weight 429.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[(2-oxo-4-phenyl-1-oxaspiro[4.5]decan-3-yl)methyl]azanium iodide
Also Known As: N,N,N-Trimethyl-2-oxo-4-phenyl-1-oxaspiro(4.5)decane-3-methanaminium iodide, 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide, (Dimethylaminomethyl)-3 phenyl-4 oxa-1 spiro(4.5)decane-one-2 iodomethylate [French], (Dimethylaminomethyl)-3 phenyl-4 oxa-1 spiro(4.5)decane-one-2 iodomethylate, N,N,N-Trimethyl(2-oxo-4-phenyl-1-oxaspiro[4.5]decan-3-yl)methanaminium iodide
| Molecular Formula | C19H28INO2 |
|---|---|
| Molecular Weight | 429.12 g/mol |
| LogP | 0.3563 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 429.1165 |
| Heavy Atoms | 23 |
| Complexity | 532.05066 |
Chemical Identifiers
| CAS Number | 78621-01-9 |
|---|---|
| SMILES | C[N+](C)(C)CC1C(C2(CCCCC2)OC1=O)C3=CC=CC=C3.[I-] |
Product Overview
1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide (CAS 78621-01-9), with molecular formula C19H28INO2 and molecular weight 429.12 g/mol. IUPAC: trimethyl-[(2-oxo-4-phenyl-1-oxaspiro[4.5]decan-3-yl)methyl]azanium iodide.
Chemical Property Profile of 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide
Property Insights of 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide
The XLogP value of 0.3563 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide. With a topological polar surface area (TPSA) of 26.3 Ų, 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide has 0 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 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide?
The CAS number of 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide is 78621-01-9.
What is the molecular formula of 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide?
The molecular formula of 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide is C19H28INO2.
What is the molecular weight of 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide?
The molecular weight of 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide is 429.12 g/mol.
Where can I buy 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide?
You can request a quote for 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for 1-Oxaspiro(4.5)decane-3-methanaminium, N,N,N-trimethyl-2-oxo-4-phenyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.