5-Isopropyl-2-methylphenyl cyclopentanecarboxylate
TL;DR: 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate (CAS 723261-17-4) is a chemical compound with molecular formula C16H22O2 and molecular weight 246.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-5-propan-2-ylphenyl) cyclopentanecarboxylate
Also Known As: 5-isopropyl-2-methylphenyl cyclopentanecarboxylate, (2-methyl-5-propan-2-ylphenyl) cyclopentanecarboxylate, AN-652/42881955
| Molecular Formula | C16H22O2 |
|---|---|
| Molecular Weight | 246.16 g/mol |
| LogP | 4.21402 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 246.16199 |
| Heavy Atoms | 18 |
| Complexity | 428.72314 |
Chemical Identifiers
| CAS Number | 723261-17-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(C)C)OC(=O)C2CCCC2 |
Product Overview
5-Isopropyl-2-methylphenyl cyclopentanecarboxylate (CAS 723261-17-4), with molecular formula C16H22O2 and molecular weight 246.16 g/mol. IUPAC: (2-methyl-5-propan-2-ylphenyl) cyclopentanecarboxylate.
Chemical Property Profile of 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate
Property Insights of 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate
The XLogP value of 4.21402 indicates that 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate 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 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate?
The CAS number of 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate is 723261-17-4.
What is the molecular formula of 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate?
The molecular formula of 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate is C16H22O2.
What is the molecular weight of 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate?
The molecular weight of 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate is 246.16 g/mol.
Where can I buy 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate?
You can request a quote for 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 5-Isopropyl-2-methylphenyl cyclopentanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.