![(3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one structure](/static/products/1234/123438-76-6.webp)
(3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one
TL;DR: (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one (CAS 123438-76-6) is a chemical compound with molecular formula C13H15NO2 and molecular weight 217.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one
Also Known As: IDI1_014269, (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one, 2(3H)-Furanone, dihydro-3-[1-[(2-methylphenyl)amino]ethylidene]-, (E)-
Technical Specifications
| Molecular Formula | C13H15NO2 |
| Molecular Weight | 217.11028 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.11028 Da |
| Heavy Atoms | 16 |
| Complexity | 309.0 |
| SMILES | CC1=CC=CC=C1N/C(=C/2\CCOC2=O)/C |
| InChIKey | UURZHQCMQSIGTL-ZHACJKMWSA-N |
Chemical Property Profile of (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one
Property Insights of (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one. With a topological polar surface area (TPSA) of 38.3 Ų, (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one has 1 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 (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one?
The CAS number of (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one is 123438-76-6.
What is the molecular formula of (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one?
The molecular formula of (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one is C13H15NO2.
What is the molecular weight of (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one?
The molecular weight of (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one is 217.11028 g/mol.
Where can I buy (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one?
You can request a quote for (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one?
Yes, CoreyChem provides custom synthesis services for (3E)-3-[1-(2-methylanilino)ethylidene]oxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.