2-Oximino-1-indanone
TL;DR: 2-Oximino-1-indanone (CAS 80070-34-4) is a chemical compound with molecular formula C9H7NO2 and molecular weight 161.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyimino-3H-inden-1-one
Also Known As: 2-Oximino-1-indanone, 1,2-Indandione-2-oxime, 2-(HYDROXYIMINO)-2,3-DIHYDRO-1H-INDEN-1-ONE, 2-hydroxyiminoindan-1-one, indan-1,2-dione-2-oxime
| Molecular Formula | C9H7NO2 |
|---|---|
| Molecular Weight | 161.05 g/mol |
| LogP | 1.2556 |
| Topological Polar Surface Area | 49.66 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.04768 |
| Heavy Atoms | 12 |
| Complexity | 368.5462 |
Chemical Identifiers
| CAS Number | 80070-34-4 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)C1=NO |
Product Overview
2-Oximino-1-indanone (CAS 80070-34-4), with molecular formula C9H7NO2 and molecular weight 161.05 g/mol. IUPAC: 2-hydroxyimino-3H-inden-1-one.
Chemical Property Profile of 2-Oximino-1-indanone
Property Insights of 2-Oximino-1-indanone
The XLogP value of 1.2556 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oximino-1-indanone. With a topological polar surface area (TPSA) of 49.66 Ų, 2-Oximino-1-indanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oximino-1-indanone has 1 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 2-Oximino-1-indanone?
The CAS number of 2-Oximino-1-indanone is 80070-34-4.
What is the molecular formula of 2-Oximino-1-indanone?
The molecular formula of 2-Oximino-1-indanone is C9H7NO2.
What is the molecular weight of 2-Oximino-1-indanone?
The molecular weight of 2-Oximino-1-indanone is 161.05 g/mol.
Where can I buy 2-Oximino-1-indanone?
You can request a quote for 2-Oximino-1-indanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oximino-1-indanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Oximino-1-indanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.