4-(己氧基)苯甲酸4-戊基苯酯
TL;DR: 4-(己氧基)苯甲酸4-戊基苯酯 (CAS 38444-15-4) is a chemical compound with molecular formula C24H32O3 and molecular weight 368.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(己氧基)苯甲酸4-戊基苯酯
(4-pentylphenyl) 4-hexoxybenzoate
Also Known As: 4-Pentylphenyl 4-hexyloxybenzoate, RHENIUM(IV)SULFIDE, 4-Pentylphenyl 4-(hexyloxy)benzoate, (4-pentylphenyl) 4-hexoxybenzoate, Benzoic acid, 4-(hexyloxy)-, 4-pentylphenyl ester
| Molecular Formula | C24H32O3 |
|---|---|
| Molecular Weight | 368.24 g/mol |
| LogP | 8.1 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 368.23514 |
| Heavy Atoms | 27 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 38444-15-4 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CCCCC |
| InChIKey | IRMSQSDYVDQMKE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(己氧基)苯甲酸4-戊基苯酯 (CAS 38444-15-4), with molecular formula C24H32O3 and molecular weight 368.24 g/mol. IUPAC: (4-pentylphenyl) 4-hexoxybenzoate.
Chemical Property Profile of 4-(己氧基)苯甲酸4-戊基苯酯
Property Insights of 4-(己氧基)苯甲酸4-戊基苯酯
The XLogP value of 8.1 indicates that 4-(己氧基)苯甲酸4-戊基苯酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 4-(己氧基)苯甲酸4-戊基苯酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(己氧基)苯甲酸4-戊基苯酯 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 4-(己氧基)苯甲酸4-戊基苯酯?
The CAS number of 4-(己氧基)苯甲酸4-戊基苯酯 is 38444-15-4.
What is the molecular formula of 4-(己氧基)苯甲酸4-戊基苯酯?
The molecular formula of 4-(己氧基)苯甲酸4-戊基苯酯 is C24H32O3.
What is the molecular weight of 4-(己氧基)苯甲酸4-戊基苯酯?
The molecular weight of 4-(己氧基)苯甲酸4-戊基苯酯 is 368.24 g/mol.
Where can I buy 4-(己氧基)苯甲酸4-戊基苯酯?
You can request a quote for 4-(己氧基)苯甲酸4-戊基苯酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(己氧基)苯甲酸4-戊基苯酯?
Yes, KEHONG BIO provides custom synthesis services for 4-(己氧基)苯甲酸4-戊基苯酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.