6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid
TL;DR: 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid (CAS 63014-66-4) is a chemical compound with molecular formula C13H18O3 and molecular weight 222.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid
Also Known As: 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid, 2-(CYCLOHEXYLIDENEMETHYL)-5,6-DIHYDRO-4H-PYRAN-3-CARBOXYLIC ACID, 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic
| Molecular Formula | C13H18O3 |
|---|---|
| Molecular Weight | 222.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.1256 |
| Heavy Atoms | 16 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 63014-66-4 |
|---|---|
| SMILES | C1CCC(=CC2=C(CCCO2)C(=O)O)CC1 |
| InChIKey | JXHNNJGVMILZBW-UHFFFAOYSA-N |
Product Overview
6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid (CAS 63014-66-4), with molecular formula C13H18O3 and molecular weight 222.13 g/mol. IUPAC: 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid.
Chemical Property Profile of 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid
Property Insights of 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid. With a topological polar surface area (TPSA) of 46.5 Ų, 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid 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 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid?
The CAS number of 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid is 63014-66-4.
What is the molecular formula of 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid?
The molecular formula of 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid is C13H18O3.
What is the molecular weight of 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid?
The molecular weight of 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid is 222.13 g/mol.
Where can I buy 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid?
You can request a quote for 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-(cyclohexylidenemethyl)-3,4-dihydro-2H-pyran-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.