2,3-Dehydrodeoxamuscarone
TL;DR: 2,3-Dehydrodeoxamuscarone (CAS 79195-22-5) is a chemical compound with molecular formula C10H18INO and molecular weight 295.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[(3-methyl-4-oxocyclopent-2-en-1-yl)methyl]azanium iodide
Also Known As: hydroxy-methyl-oxotin, 2,3-Dehydrodeoxamuscarone, 2-Cyclopentene-1-methanaminium, N,N,N,3-tetramethyl-4-oxo-, iodide, 3-Methyl-4-oxo-1-(N,N-dimethylaminomethyl)cyclopent-2-ene, 2-cyclopentene-1-methanaminium, n,n,n,3-tetramethyl-4-oxo-,iodide
| Molecular Formula | C10H18INO |
|---|---|
| Molecular Weight | 295.04 g/mol |
| LogP | -1.7681 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.0433 |
| Heavy Atoms | 13 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 79195-22-5 |
|---|---|
| SMILES | CC1=CC(CC1=O)C[N+](C)(C)C.[I-] |
| InChIKey | JNKUQDCQISILOT-UHFFFAOYSA-M |
Product Overview
2,3-Dehydrodeoxamuscarone (CAS 79195-22-5), with molecular formula C10H18INO and molecular weight 295.04 g/mol. IUPAC: trimethyl-[(3-methyl-4-oxocyclopent-2-en-1-yl)methyl]azanium iodide.
Chemical Property Profile of 2,3-Dehydrodeoxamuscarone
Property Insights of 2,3-Dehydrodeoxamuscarone
The XLogP value of -1.7681 indicates that 2,3-Dehydrodeoxamuscarone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 17.1 Ų, 2,3-Dehydrodeoxamuscarone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dehydrodeoxamuscarone 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 2,3-Dehydrodeoxamuscarone?
The CAS number of 2,3-Dehydrodeoxamuscarone is 79195-22-5.
What is the molecular formula of 2,3-Dehydrodeoxamuscarone?
The molecular formula of 2,3-Dehydrodeoxamuscarone is C10H18INO.
What is the molecular weight of 2,3-Dehydrodeoxamuscarone?
The molecular weight of 2,3-Dehydrodeoxamuscarone is 295.04 g/mol.
Where can I buy 2,3-Dehydrodeoxamuscarone?
You can request a quote for 2,3-Dehydrodeoxamuscarone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dehydrodeoxamuscarone?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dehydrodeoxamuscarone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.