1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)-
TL;DR: 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- (CAS 28998-50-7) is a chemical compound with molecular formula C17H22O2 and molecular weight 258.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-cyclohexyl-2,3-dihydro-1H-indene-1-carboxylate
Also Known As: Methyl (-)-5-cyclohexylindan-1-carboxylate, methyl 5-cyclohexylindane-1-carboxylate, Methyl (+-)-5-cyclohexylindan-1-carboxylate, 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)-, 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (-)-
| Molecular Formula | C17H22O2 |
|---|---|
| Molecular Weight | 258.16 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.162 |
| Heavy Atoms | 19 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 28998-50-7 |
|---|---|
| SMILES | COC(=O)C1CCC2=C1C=CC(=C2)C3CCCCC3 |
| InChIKey | CPBGSLIVFJMDAK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- (CAS 28998-50-7), with molecular formula C17H22O2 and molecular weight 258.16 g/mol. IUPAC: methyl 5-cyclohexyl-2,3-dihydro-1H-indene-1-carboxylate.
Chemical Property Profile of 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)-
Property Insights of 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)-
The XLogP value of 4.7 indicates that 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- 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-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)-?
The CAS number of 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- is 28998-50-7.
What is the molecular formula of 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)-?
The molecular formula of 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- is C17H22O2.
What is the molecular weight of 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)-?
The molecular weight of 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- is 258.16 g/mol.
Where can I buy 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)-?
You can request a quote for 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Indancarboxylic acid, 5-cyclohexyl-, methyl ester, (+-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.