Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate
TL;DR: Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate (CAS 55269-96-0) is a chemical compound with molecular formula C11H11NO3 and molecular weight 205.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate
Also Known As: methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate, methyl (3Z)-3-hydroxyimino-1,2-dihydroindene-2-carboxylate
| Molecular Formula | C11H11NO3 |
|---|---|
| Molecular Weight | 205.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.0739 |
| Heavy Atoms | 15 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 55269-96-0 |
|---|---|
| SMILES | COC(=O)C1CC2=CC=CC=C2C1=NO |
| InChIKey | GOOLZMPFKPROBJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate (CAS 55269-96-0), with molecular formula C11H11NO3 and molecular weight 205.07 g/mol. IUPAC: methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate.
Chemical Property Profile of Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate
Property Insights of Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate. With a topological polar surface area (TPSA) of 58.9 Ų, Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate has 1 hydrogen bond donor(s) and 4 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 Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate?
The CAS number of Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate is 55269-96-0.
What is the molecular formula of Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate?
The molecular formula of Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate is C11H11NO3.
What is the molecular weight of Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate?
The molecular weight of Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate is 205.07 g/mol.
Where can I buy Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate?
You can request a quote for Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-hydroxyimino-1,2-dihydroindene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.