1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-
TL;DR: 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl- (CAS 78620-89-0) is a chemical compound with molecular formula C17H23NO2 and molecular weight 273.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(dimethylamino)methyl]-4-phenyl-1-oxaspiro[4.4]nonan-2-one
Also Known As: 3-((Dimethylamino)methyl)-4-phenyl-1-oxaspiro(4.4)nonan-2-one, 3-[(dimethylamino)methyl]-4-phenyl-1-oxaspiro[4.4]nonan-2-one, 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-, (Dimethylaminomethyl)-3 phenyl-4 oxa-1 spiro(4.4)nonane-one-2, (Dimethylaminomethyl)-3 phenyl-4 oxa-1 spiro(4.4)nonane-one-2 [French]
| Molecular Formula | C17H23NO2 |
|---|---|
| Molecular Weight | 273.17 g/mol |
| LogP | 2.8176 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 273.17288 |
| Heavy Atoms | 20 |
| Complexity | 477.0232 |
Chemical Identifiers
| CAS Number | 78620-89-0 |
|---|---|
| SMILES | CN(C)CC1C(C2(CCCC2)OC1=O)C3=CC=CC=C3 |
Product Overview
1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl- (CAS 78620-89-0), with molecular formula C17H23NO2 and molecular weight 273.17 g/mol. IUPAC: 3-[(dimethylamino)methyl]-4-phenyl-1-oxaspiro[4.4]nonan-2-one.
Chemical Property Profile of 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-
Property Insights of 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-
The XLogP value of 2.8176 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-. With a topological polar surface area (TPSA) of 29.54 Ų, 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl- has 0 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 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-?
The CAS number of 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl- is 78620-89-0.
What is the molecular formula of 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-?
The molecular formula of 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl- is C17H23NO2.
What is the molecular weight of 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-?
The molecular weight of 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl- is 273.17 g/mol.
Where can I buy 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-?
You can request a quote for 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Oxaspiro(4.4)nonan-2-one, 3-((dimethylamino)methyl)-4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.