Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester
TL;DR: Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester (CAS 38444-08-5) is a chemical compound with molecular formula C23H30O3 and molecular weight 354.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-butylphenyl) 4-hexoxybenzoate
Also Known As: 4-Butylphenyl 4-hexyloxybenzoate, (4-butylphenyl) 4-hexoxybenzoate, Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester, 4-butylphenyl 4-n-hexoxybenzoate, 4-BUTYLPHENYL 4-(HEXYLOXY)BENZOATE
| Molecular Formula | C23H30O3 |
|---|---|
| Molecular Weight | 354.22 g/mol |
| LogP | 6.2075 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 354.21948 |
| Heavy Atoms | 26 |
| Complexity | 644.1581 |
Chemical Identifiers
| CAS Number | 38444-08-5 |
|---|---|
| SMILES | CCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CCCC |
Product Overview
Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester (CAS 38444-08-5), with molecular formula C23H30O3 and molecular weight 354.22 g/mol. IUPAC: (4-butylphenyl) 4-hexoxybenzoate.
Chemical Property Profile of Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester
Property Insights of Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester
The XLogP value of 6.2075 indicates that Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester 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 Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester?
The CAS number of Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester is 38444-08-5.
What is the molecular formula of Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester?
The molecular formula of Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester is C23H30O3.
What is the molecular weight of Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester?
The molecular weight of Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester is 354.22 g/mol.
Where can I buy Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester?
You can request a quote for Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-(hexyloxy)-, 4-butylphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.