3,5-二丙基-4-乙氧基苯甲酸乙酯
TL;DR: 3,5-二丙基-4-乙氧基苯甲酸乙酯 (CAS 100482-26-6) is a chemical compound with molecular formula C17H26O3 and molecular weight 278.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-二丙基-4-乙氧基苯甲酸乙酯
ethyl 4-ethoxy-3,5-dipropylbenzoate
Also Known As: Ethyl 4-ethoxy-3,5-dipropylbenzoate, 3,5-Dipropyl-4-ethoxybenzoic acid ethyl ester, BENZOIC ACID, 3,5-DIPROPYL-4-ETHOXY-, ETHYL ESTER, Benzoic acid,4-ethoxy-3,5-dipropyl-, ethyl ester, Benzoic acid, 4-ethoxy-3,5-dipropyl-, ethyl ester
| Molecular Formula | C17H26O3 |
|---|---|
| Molecular Weight | 278.19 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 278.1882 |
| Heavy Atoms | 20 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 100482-26-6 |
|---|---|
| SMILES | CCCC1=CC(=CC(=C1OCC)CCC)C(=O)OCC |
| InChIKey | BXARXLWSBTVJNV-UHFFFAOYSA-N |
Product Overview
3,5-二丙基-4-乙氧基苯甲酸乙酯 (CAS 100482-26-6), with molecular formula C17H26O3 and molecular weight 278.19 g/mol. IUPAC: ethyl 4-ethoxy-3,5-dipropylbenzoate.
Chemical Property Profile of 3,5-二丙基-4-乙氧基苯甲酸乙酯
Property Insights of 3,5-二丙基-4-乙氧基苯甲酸乙酯
The XLogP value of 5.2 indicates that 3,5-二丙基-4-乙氧基苯甲酸乙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 3,5-二丙基-4-乙氧基苯甲酸乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-二丙基-4-乙氧基苯甲酸乙酯 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-二丙基-4-乙氧基苯甲酸乙酯?
The CAS number of 3,5-二丙基-4-乙氧基苯甲酸乙酯 is 100482-26-6.
What is the molecular formula of 3,5-二丙基-4-乙氧基苯甲酸乙酯?
The molecular formula of 3,5-二丙基-4-乙氧基苯甲酸乙酯 is C17H26O3.
What is the molecular weight of 3,5-二丙基-4-乙氧基苯甲酸乙酯?
The molecular weight of 3,5-二丙基-4-乙氧基苯甲酸乙酯 is 278.19 g/mol.
Where can I buy 3,5-二丙基-4-乙氧基苯甲酸乙酯?
You can request a quote for 3,5-二丙基-4-乙氧基苯甲酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-二丙基-4-乙氧基苯甲酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for 3,5-二丙基-4-乙氧基苯甲酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.