5-Isopropyl-2-methylphenyl 3-methoxybenzoate
TL;DR: 5-Isopropyl-2-methylphenyl 3-methoxybenzoate (CAS 723261-60-7) is a chemical compound with molecular formula C18H20O3 and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-5-propan-2-ylphenyl) 3-methoxybenzoate
Also Known As: 5-isopropyl-2-methylphenyl 3-methoxybenzoate, (2-methyl-5-propan-2-ylphenyl) 3-methoxybenzoate, AN-652/42917589
| Molecular Formula | C18H20O3 |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 4.34622 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.14124 |
| Heavy Atoms | 21 |
| Complexity | 644.66174 |
Chemical Identifiers
| CAS Number | 723261-60-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(C)C)OC(=O)C2=CC(=CC=C2)OC |
Product Overview
5-Isopropyl-2-methylphenyl 3-methoxybenzoate (CAS 723261-60-7), with molecular formula C18H20O3 and molecular weight 284.14 g/mol. IUPAC: (2-methyl-5-propan-2-ylphenyl) 3-methoxybenzoate.
Chemical Property Profile of 5-Isopropyl-2-methylphenyl 3-methoxybenzoate
Property Insights of 5-Isopropyl-2-methylphenyl 3-methoxybenzoate
The XLogP value of 4.34622 indicates that 5-Isopropyl-2-methylphenyl 3-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 5-Isopropyl-2-methylphenyl 3-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Isopropyl-2-methylphenyl 3-methoxybenzoate 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 5-Isopropyl-2-methylphenyl 3-methoxybenzoate?
The CAS number of 5-Isopropyl-2-methylphenyl 3-methoxybenzoate is 723261-60-7.
What is the molecular formula of 5-Isopropyl-2-methylphenyl 3-methoxybenzoate?
The molecular formula of 5-Isopropyl-2-methylphenyl 3-methoxybenzoate is C18H20O3.
What is the molecular weight of 5-Isopropyl-2-methylphenyl 3-methoxybenzoate?
The molecular weight of 5-Isopropyl-2-methylphenyl 3-methoxybenzoate is 284.14 g/mol.
Where can I buy 5-Isopropyl-2-methylphenyl 3-methoxybenzoate?
You can request a quote for 5-Isopropyl-2-methylphenyl 3-methoxybenzoate 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 3-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 5-Isopropyl-2-methylphenyl 3-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.