3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride
TL;DR: 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride (CAS 78620-99-2) is a chemical compound with molecular formula C19H28ClNO2 and molecular weight 337.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(dimethylamino)methyl]-4-(4-methylphenyl)-1-oxaspiro[4.5]decan-2-one;hydrochloride
Also Known As: 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride, (Dimethylaminomethyl)-3 (p-tolyl)-4 oxa-1 spiro(4.5)decane-one-2 chlorhydrate [French], 1-Oxaspiro(4.5)decan-2-one, 3-((dimethylamino)methyl)-4-(4-methylphenyl)-, hydrochloride, (Dimethylaminomethyl)-3 (p-tolyl)-4 oxa-1 spiro(4.5)decane-one-2 chlorhydrate, 2-(dimethylaminomethyl)-1-(4-methylphenyl)-4-oxaspiro[4.5]decan-3-one hydrochloride
| Molecular Formula | C19H28ClNO2 |
|---|---|
| Molecular Weight | 337.18 g/mol |
| LogP | 3.93792 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.18085 |
| Heavy Atoms | 23 |
| Complexity | 534.80554 |
Chemical Identifiers
| CAS Number | 78620-99-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C(C(=O)OC23CCCCC3)CN(C)C.Cl |
Product Overview
3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride (CAS 78620-99-2), with molecular formula C19H28ClNO2 and molecular weight 337.18 g/mol. IUPAC: 3-[(dimethylamino)methyl]-4-(4-methylphenyl)-1-oxaspiro[4.5]decan-2-one;hydrochloride.
Chemical Property Profile of 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride
Property Insights of 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride
The XLogP value of 3.93792 indicates that 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride 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 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride?
The CAS number of 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride is 78620-99-2.
What is the molecular formula of 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride?
The molecular formula of 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride is C19H28ClNO2.
What is the molecular weight of 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride?
The molecular weight of 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride is 337.18 g/mol.
Where can I buy 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride?
You can request a quote for 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-((Dimethylamino)methyl)-4-(4-methylphenyl)-1-oxaspiro(4.5)decan-2-one hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.