Methyl indane-2-carboxylate
TL;DR: Methyl indane-2-carboxylate (CAS 4254-32-4) is a chemical compound with molecular formula C11H12O2 and molecular weight 176.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2,3-dihydro-1H-indene-2-carboxylate
Also Known As: methyl indane-2-carboxylate, Methyl 2,3-dihydro-1H-indene-2-carboxylate, 2-carbomethoxy-indan, 2-carbomethoxyindane, 2(carbomethoxy)indan
| Molecular Formula | C11H12O2 |
|---|---|
| Molecular Weight | 176.08 g/mol |
| LogP | 1.5744 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.08372 |
| Heavy Atoms | 13 |
| Complexity | 305.6171 |
Chemical Identifiers
| CAS Number | 4254-32-4 |
|---|---|
| SMILES | COC(=O)C1CC2=CC=CC=C2C1 |
Product Overview
Methyl indane-2-carboxylate (CAS 4254-32-4), with molecular formula C11H12O2 and molecular weight 176.08 g/mol. IUPAC: methyl 2,3-dihydro-1H-indene-2-carboxylate.
Chemical Property Profile of Methyl indane-2-carboxylate
Property Insights of Methyl indane-2-carboxylate
The XLogP value of 1.5744 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl indane-2-carboxylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl indane-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl indane-2-carboxylate 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 Methyl indane-2-carboxylate?
The CAS number of Methyl indane-2-carboxylate is 4254-32-4.
What is the molecular formula of Methyl indane-2-carboxylate?
The molecular formula of Methyl indane-2-carboxylate is C11H12O2.
What is the molecular weight of Methyl indane-2-carboxylate?
The molecular weight of Methyl indane-2-carboxylate is 176.08 g/mol.
Where can I buy Methyl indane-2-carboxylate?
You can request a quote for Methyl indane-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 indane-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl indane-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.