2H-1-Benzopyran-2-one, 7-ethyl-4-methyl-
TL;DR: 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl- (CAS 101999-44-4) is a chemical compound with molecular formula C12H12O2 and molecular weight 188.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-ethyl-4-methylchromen-2-one
Also Known As: 7-ethyl-4-methyl-2H-chromen-2-one, 7-ethyl-4-methylchromen-2-one, Bionet2_001122, 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl-, 4-methyl-7-ethyl-coumarin
Technical Specifications
| Molecular Formula | C12H12O2 |
| Molecular Weight | 188.08372 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.08372 Da |
| Heavy Atoms | 14 |
| Complexity | 267.0 |
| SMILES | CCC1=CC2=C(C=C1)C(=CC(=O)O2)C |
| InChIKey | KBAOONDOLHDLDN-UHFFFAOYSA-N |
Chemical Property Profile of 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl-
Property Insights of 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl-
The XLogP value of 3.1 indicates that 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl- 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
What is the CAS number of 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl-?
The CAS number of 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl- is 101999-44-4.
What is the molecular formula of 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl-?
The molecular formula of 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl- is C12H12O2.
What is the molecular weight of 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl-?
The molecular weight of 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl- is 188.08372 g/mol.
Where can I buy 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl-?
You can request a quote for 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl-?
Yes, CoreyChem provides custom synthesis services for 2H-1-Benzopyran-2-one, 7-ethyl-4-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.