4-Methyl-7-diethylaminocoumarin
TL;DR: 4-Methyl-7-diethylaminocoumarin (CAS 91-44-1) is a chemical compound with molecular formula C14H17NO2 and molecular weight 231.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-(diethylamino)-4-methylchromen-2-one
Also Known As: Coumarin 1, 7-DIETHYLAMINO-4-METHYLCOUMARIN, Coumarin 460, Coumarin 47, Blancophor AW
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H17NO2 |
| Molecular Weight | 231.12593 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 231.12593 Da |
| Heavy Atoms | 17 |
| Complexity | 320.0 |
| Melting Point | 154 to 162 °F (NTP, 1992) |
| Solubility | Slightly soluble in hot solvent (NTP, 1992) |
| SMILES | CCN(CC)C1=CC2=C(C=C1)C(=CC(=O)O2)C |
| InChIKey | AFYCEAFSNDLKSX-UHFFFAOYSA-N |
Product Description
Applications: 4-Methyl-7-diethylaminocoumarin is used in surfactant and detergent formulations, as well as imaging, photographic, and photosensitive formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Methyl-7-diethylaminocoumarin (CAS 91-44-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
4-Methyl-7-diethylaminocoumarin (CAS 91-44-1) is a surfactant raw material with the molecular formula C14H17NO2 and a molecular weight of 231.13 g/mol. Key physical properties include a solubility: Slightly soluble in hot solvent (NTP, 1992). It is also known as Coumarin 1 and 7-DIETHYLAMINO-4-METHYLCOUMARIN.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Methyl-7-diethylaminocoumarin
Property Insights of 4-Methyl-7-diethylaminocoumarin
The XLogP value of 3.1 indicates that 4-Methyl-7-diethylaminocoumarin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 4-Methyl-7-diethylaminocoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-7-diethylaminocoumarin 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
What is the CAS number of 4-Methyl-7-diethylaminocoumarin?
The CAS number of 4-Methyl-7-diethylaminocoumarin is 91-44-1.
What is the molecular formula of 4-Methyl-7-diethylaminocoumarin?
The molecular formula of 4-Methyl-7-diethylaminocoumarin is C14H17NO2.
What is the molecular weight of 4-Methyl-7-diethylaminocoumarin?
The molecular weight of 4-Methyl-7-diethylaminocoumarin is 231.12593 g/mol.
What are the applications of 4-Methyl-7-diethylaminocoumarin?
4-Methyl-7-diethylaminocoumarin is used in surfactant and detergent formulations, as well as imaging, photographic, and photosensitive formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Methyl-7-diethylaminocoumarin (CAS 91-44-1) with...
Where can I buy 4-Methyl-7-diethylaminocoumarin?
You can request a quote for 4-Methyl-7-diethylaminocoumarin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methyl-7-diethylaminocoumarin?
Yes, CoreyChem provides custom synthesis services for 4-Methyl-7-diethylaminocoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.