![1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride structure](/static/products/104/1049743-37-4.webp)
1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride
TL;DR: 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride (CAS 1049743-37-4) is a chemical compound with molecular formula C13H20ClNO2 and molecular weight 257.11826 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-(diethylaminomethyl)-4-hydroxyphenyl]ethanone;hydrochloride
Also Known As: 1-{3-[(diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride, 1-{3-[(diethylamino)methyl]-4-hydroxyphenyl}ethanone hydrochloride, (R)-3-(Hexadecanoyloxy)tetradecanoic acid, 1-(3-((Diethylamino)methyl)-4-hydroxyphenyl)ethanone hydrochloride, 1-(3-[(Diethylamino)methyl]-4-hydroxyphenyl)ethanone hydrochloride
Technical Specifications
| Molecular Formula | C13H20ClNO2 |
| Molecular Weight | 257.11826 g/mol |
| XLogP | 2.8584 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.11826 Da |
| Heavy Atoms | 17 |
| Complexity | 226.0 |
| SMILES | CCN(CC)CC1=C(C=CC(=C1)C(=O)C)O.Cl |
| InChIKey | KWWDRZMSBBDDJK-UHFFFAOYSA-N |
Chemical Property Profile of 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride
Property Insights of 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride
The XLogP value of 2.8584 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride. With a topological polar surface area (TPSA) of 40.5 Ų, 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride?
The CAS number of 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride is 1049743-37-4.
What is the molecular formula of 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride?
The molecular formula of 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride is C13H20ClNO2.
What is the molecular weight of 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride?
The molecular weight of 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride is 257.11826 g/mol.
Where can I buy 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride?
You can request a quote for 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride?
Yes, CoreyChem provides custom synthesis services for 1-{3-[(Diethylamino)methyl]-4-hydroxyphenyl}ethan-1-one hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.