1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-
TL;DR: 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)- (CAS 60575-28-2) is a chemical compound with molecular formula C12H12OS2 and molecular weight 236.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dithiolan-2-yl)-2,3-dihydroinden-1-one
Also Known As: 2,3-Dihydro-2-(1,3-dithiolan-2-yl)-1H-inden-1-one, 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-, 2-(1,3-dithiolan-2-yl)-2,3-dihydroinden-1-one, 2-(1,3-Dithiolan-2-yl)-2,3-dihydro-1H-inden-1-one, RefChem:1058101
| Molecular Formula | C12H12OS2 |
|---|---|
| Molecular Weight | 236.03 g/mol |
| LogP | 2.8477 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.03296 |
| Heavy Atoms | 15 |
| Complexity | 396.36353 |
Chemical Identifiers
| CAS Number | 60575-28-2 |
|---|---|
| SMILES | C1CSC(S1)C2CC3=CC=CC=C3C2=O |
Product Overview
1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)- (CAS 60575-28-2), with molecular formula C12H12OS2 and molecular weight 236.03 g/mol. IUPAC: 2-(1,3-dithiolan-2-yl)-2,3-dihydroinden-1-one.
Chemical Property Profile of 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-
Property Insights of 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-
The XLogP value of 2.8477 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-. With a topological polar surface area (TPSA) of 17.07 Ų, 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)- 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
Frequently Asked Questions
What is the CAS number of 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-?
The CAS number of 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)- is 60575-28-2.
What is the molecular formula of 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-?
The molecular formula of 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)- is C12H12OS2.
What is the molecular weight of 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-?
The molecular weight of 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)- is 236.03 g/mol.
Where can I buy 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-?
You can request a quote for 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Inden-1-one, 2,3-dihydro-2-(1,3-dithiolan-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.