1H-Indene-1,3(2H)-dione, 2-ethyl-
TL;DR: 1H-Indene-1,3(2H)-dione, 2-ethyl- (CAS 27606-61-7) is a chemical compound with molecular formula C11H10O2 and molecular weight 174.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylindene-1,3-dione
Also Known As: 2-Ethyl-1,3-indandione, 2-Ethylindan-1,3-dione, 2-ethylindene-1,3-dione, 2-Ethylindane-1,3-dione, 1H-Indene-1,3(2H)-dione, 2-ethyl-
| Molecular Formula | C11H10O2 |
|---|---|
| Molecular Weight | 174.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.06808 |
| Heavy Atoms | 13 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 27606-61-7 |
|---|---|
| SMILES | CCC1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | CBEKYPINWJEJBP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Indene-1,3(2H)-dione, 2-ethyl- (CAS 27606-61-7), with molecular formula C11H10O2 and molecular weight 174.07 g/mol. IUPAC: 2-ethylindene-1,3-dione.
Chemical Property Profile of 1H-Indene-1,3(2H)-dione, 2-ethyl-
Property Insights of 1H-Indene-1,3(2H)-dione, 2-ethyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indene-1,3(2H)-dione, 2-ethyl-. With a topological polar surface area (TPSA) of 34.1 Ų, 1H-Indene-1,3(2H)-dione, 2-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indene-1,3(2H)-dione, 2-ethyl- 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
Frequently Asked Questions
What is the CAS number of 1H-Indene-1,3(2H)-dione, 2-ethyl-?
The CAS number of 1H-Indene-1,3(2H)-dione, 2-ethyl- is 27606-61-7.
What is the molecular formula of 1H-Indene-1,3(2H)-dione, 2-ethyl-?
The molecular formula of 1H-Indene-1,3(2H)-dione, 2-ethyl- is C11H10O2.
What is the molecular weight of 1H-Indene-1,3(2H)-dione, 2-ethyl-?
The molecular weight of 1H-Indene-1,3(2H)-dione, 2-ethyl- is 174.07 g/mol.
Where can I buy 1H-Indene-1,3(2H)-dione, 2-ethyl-?
You can request a quote for 1H-Indene-1,3(2H)-dione, 2-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indene-1,3(2H)-dione, 2-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indene-1,3(2H)-dione, 2-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.