![1-(ethoxymethyl)benzo[cd]indol-2(1H)-one structure](/static/products/1140/114044-37-0.webp)
1-(ethoxymethyl)benzo[cd]indol-2(1H)-one
TL;DR: 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one (CAS 114044-37-0) is a chemical compound with molecular formula C14H13NO2 and molecular weight 227.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(ethoxymethyl)benzo[cd]indol-2-one
Also Known As: 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one, IFLab1_001121, BAS 00917478, 1-(ethoxymethyl)benzo[cd]indol-2-one, IDI1_008988
Technical Specifications
| Molecular Formula | C14H13NO2 |
| Molecular Weight | 227.09464 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.09464 Da |
| Heavy Atoms | 17 |
| Complexity | 305.0 |
| SMILES | CCOCN1C2=CC=CC3=C2C(=CC=C3)C1=O |
| InChIKey | NDCSYAWFNJMLRY-UHFFFAOYSA-N |
Chemical Property Profile of 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one
Property Insights of 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one. With a topological polar surface area (TPSA) of 29.5 Ų, 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one 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 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one?
The CAS number of 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one is 114044-37-0.
What is the molecular formula of 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one?
The molecular formula of 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one is C14H13NO2.
What is the molecular weight of 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one?
The molecular weight of 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one is 227.09464 g/mol.
Where can I buy 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one?
You can request a quote for 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one?
Yes, CoreyChem provides custom synthesis services for 1-(ethoxymethyl)benzo[cd]indol-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.