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Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester
TL;DR: Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester (CAS 108134-05-0) is a chemical compound with molecular formula C30H44O4 and molecular weight 468.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-methylhexoxy)phenyl] 4-decoxybenzoate
Also Known As: [4-(4-methylhexoxy)phenyl] 4-decoxybenzoate, J1.192.931A, Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester, 4-[(4-METHYLHEXYL)OXY]PHENYL 4-(DECYLOXY)BENZOATE, 4-Decyloxybenzoic acid 4-(4-methylhexyloxy)phenyl ester
| Molecular Formula | C30H44O4 |
|---|---|
| Molecular Weight | 468.32 g/mol |
| LogP | 8.6304 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 468.32397 |
| Heavy Atoms | 34 |
| Complexity | 782.4576 |
Chemical Identifiers
| CAS Number | 108134-05-0 |
|---|---|
| SMILES | CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCCC(C)CC |
Product Overview
Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester (CAS 108134-05-0), with molecular formula C30H44O4 and molecular weight 468.32 g/mol. IUPAC: [4-(4-methylhexoxy)phenyl] 4-decoxybenzoate.
Chemical Property Profile of Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester
Property Insights of Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester
The XLogP value of 8.6304 indicates that Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester has 0 hydrogen bond donor(s) and 4 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-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester?
The CAS number of Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester is 108134-05-0.
What is the molecular formula of Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester?
The molecular formula of Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester is C30H44O4.
What is the molecular weight of Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester?
The molecular weight of Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester is 468.32 g/mol.
Where can I buy Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester?
You can request a quote for Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl 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-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-(decyloxy)-, 4-[(4-methylhexyl)oxy]phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.