1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile
TL;DR: 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile (CAS 60899-34-5) is a chemical compound with molecular formula C10H7NO and molecular weight 157.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-oxo-2,3-dihydroindene-4-carbonitrile
Also Known As: 1-Oxo-2,3-dihydro-1H-indene-4-carbonitrile, 2,3-dihydro-1-oxo-1H-indene-4-carbonitrile, 4-Cyano-1-indanone, 4-Cyanoindanone, Ozanimod Impurity 2
| Molecular Formula | C10H7NO |
|---|---|
| Molecular Weight | 157.05 g/mol |
| LogP | 1.68718 |
| Topological Polar Surface Area | 40.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 157.05276 |
| Heavy Atoms | 12 |
| Complexity | 387.3153 |
Chemical Identifiers
| CAS Number | 60899-34-5 |
|---|---|
| SMILES | C1CC(=O)C2=CC=CC(=C21)C#N |
Product Overview
1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile (CAS 60899-34-5), with molecular formula C10H7NO and molecular weight 157.05 g/mol. IUPAC: 1-oxo-2,3-dihydroindene-4-carbonitrile.
Chemical Property Profile of 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile
Property Insights of 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile
The XLogP value of 1.68718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile. With a topological polar surface area (TPSA) of 40.86 Ų, 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile 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 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile?
The CAS number of 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile is 60899-34-5.
What is the molecular formula of 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile?
The molecular formula of 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile is C10H7NO.
What is the molecular weight of 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile?
The molecular weight of 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile is 157.05 g/mol.
Where can I buy 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile?
You can request a quote for 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-Oxo-2,3-Dihydro-1H-Indene-4-Carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.