2-Indanone, 4,5,6,7-tetrahydro-
TL;DR: 2-Indanone, 4,5,6,7-tetrahydro- (CAS 20990-33-4) is a chemical compound with molecular formula C9H12O and molecular weight 136.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,4,5,6,7-hexahydroinden-2-one
Also Known As: 2-Indanone, 4,5,6,7-tetrahydro-, 4,5,6,7-Tetrahydroindan-2-one, 1,3,4,5,6,7-hexahydroinden-2-one, 1,3,4,5,6,7-Hexahydro-2H-inden-2-one, 1,3,4,5,6,7-hexahydro-inden-2-one
| Molecular Formula | C9H12O |
|---|---|
| Molecular Weight | 136.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 136.08882 |
| Heavy Atoms | 10 |
| Complexity | 181.0 |
Chemical Identifiers
| CAS Number | 20990-33-4 |
|---|---|
| SMILES | C1CCC2=C(C1)CC(=O)C2 |
| InChIKey | YQJBFSQIAFXWPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Indanone, 4,5,6,7-tetrahydro- (CAS 20990-33-4), with molecular formula C9H12O and molecular weight 136.09 g/mol. IUPAC: 1,3,4,5,6,7-hexahydroinden-2-one.
Chemical Property Profile of 2-Indanone, 4,5,6,7-tetrahydro-
Property Insights of 2-Indanone, 4,5,6,7-tetrahydro-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Indanone, 4,5,6,7-tetrahydro-. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Indanone, 4,5,6,7-tetrahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Indanone, 4,5,6,7-tetrahydro- has 0 hydrogen bond donor(s) and 1 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 2-Indanone, 4,5,6,7-tetrahydro-?
The CAS number of 2-Indanone, 4,5,6,7-tetrahydro- is 20990-33-4.
What is the molecular formula of 2-Indanone, 4,5,6,7-tetrahydro-?
The molecular formula of 2-Indanone, 4,5,6,7-tetrahydro- is C9H12O.
What is the molecular weight of 2-Indanone, 4,5,6,7-tetrahydro-?
The molecular weight of 2-Indanone, 4,5,6,7-tetrahydro- is 136.09 g/mol.
Where can I buy 2-Indanone, 4,5,6,7-tetrahydro-?
You can request a quote for 2-Indanone, 4,5,6,7-tetrahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Indanone, 4,5,6,7-tetrahydro-?
Yes, KEHONG BIO provides custom synthesis services for 2-Indanone, 4,5,6,7-tetrahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.