5-amino-2,3-dihydro-1H-inden-1-one
TL;DR: 5-amino-2,3-dihydro-1H-inden-1-one (CAS 20876-36-2) is a chemical compound with molecular formula C9H9NO and molecular weight 147.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2,3-dihydroinden-1-one
Also Known As: 5-Aminoindan-1-one, 5-Amino-1-indanone, null, 5-amino-2,3-dihydroinden-1-one, 5-aminoindanone
| Molecular Formula | C9H9NO |
|---|---|
| Molecular Weight | 147.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.06842 |
| Heavy Atoms | 11 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 20876-36-2 |
|---|---|
| SMILES | C1CC(=O)C2=C1C=C(C=C2)N |
| InChIKey | HODOSJNSRPXYBH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-amino-2,3-dihydro-1H-inden-1-one (CAS 20876-36-2), with molecular formula C9H9NO and molecular weight 147.07 g/mol. IUPAC: 5-amino-2,3-dihydroinden-1-one.
Chemical Property Profile of 5-amino-2,3-dihydro-1H-inden-1-one
Property Insights of 5-amino-2,3-dihydro-1H-inden-1-one
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-amino-2,3-dihydro-1H-inden-1-one. With a topological polar surface area (TPSA) of 43.1 Ų, 5-amino-2,3-dihydro-1H-inden-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-amino-2,3-dihydro-1H-inden-1-one has 1 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 5-amino-2,3-dihydro-1H-inden-1-one?
The CAS number of 5-amino-2,3-dihydro-1H-inden-1-one is 20876-36-2.
What is the molecular formula of 5-amino-2,3-dihydro-1H-inden-1-one?
The molecular formula of 5-amino-2,3-dihydro-1H-inden-1-one is C9H9NO.
What is the molecular weight of 5-amino-2,3-dihydro-1H-inden-1-one?
The molecular weight of 5-amino-2,3-dihydro-1H-inden-1-one is 147.07 g/mol.
Where can I buy 5-amino-2,3-dihydro-1H-inden-1-one?
You can request a quote for 5-amino-2,3-dihydro-1H-inden-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-2,3-dihydro-1H-inden-1-one?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-2,3-dihydro-1H-inden-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.