Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate
TL;DR: Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate (CAS 29427-70-1) is a chemical compound with molecular formula C11H10O3 and molecular weight 190.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-oxo-1,2-dihydroindene-1-carboxylate
Also Known As: Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate, Methyl 3-oxo-indan-1-carboxylate, methyl 3-oxoindane-1-carboxylate, methyl 3-oxo-1,2-dihydroindene-1-carboxylate, 3-carboxy-1-indanone methyl ester
| Molecular Formula | C11H10O3 |
|---|---|
| Molecular Weight | 190.06 g/mol |
| LogP | 1.5296 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.06299 |
| Heavy Atoms | 14 |
| Complexity | 395.27405 |
Chemical Identifiers
| CAS Number | 29427-70-1 |
|---|---|
| SMILES | COC(=O)C1CC(=O)C2=CC=CC=C12 |
Product Overview
Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate (CAS 29427-70-1), with molecular formula C11H10O3 and molecular weight 190.06 g/mol. IUPAC: methyl 3-oxo-1,2-dihydroindene-1-carboxylate.
Chemical Property Profile of Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate
Property Insights of Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate
The XLogP value of 1.5296 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate. With a topological polar surface area (TPSA) of 43.37 Ų, Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate has 0 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 Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate?
The CAS number of Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate is 29427-70-1.
What is the molecular formula of Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate?
The molecular formula of Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate is C11H10O3.
What is the molecular weight of Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate?
The molecular weight of Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate is 190.06 g/mol.
Where can I buy Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate?
You can request a quote for Methyl 3-oxo-2,3-dihydro-1H-indene-1-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-oxo-2,3-dihydro-1H-indene-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-oxo-2,3-dihydro-1H-indene-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.