Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-
TL;DR: Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy- (CAS 7478-73-1) is a chemical compound with molecular formula C19H20O5 and molecular weight 328.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-benzoyloxy-3-methoxyphenyl)pentanoic acid
Also Known As: 5-(4-benzoyloxy-3-methoxyphenyl)pentanoic acid, Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-, 5-(3-Methoxy-4-benzoyloxy-phenyl)-valeriansaeure, 5-[4-(BENZOYLOXY)-3-METHOXYPHENYL]PENTANOIC ACID
| Molecular Formula | C19H20O5 |
|---|---|
| Molecular Weight | 328.13 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 328.13107 |
| Heavy Atoms | 24 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 7478-73-1 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)CCCCC(=O)O)OC(=O)C2=CC=CC=C2 |
| InChIKey | ZPJRFZHJKDKKEI-UHFFFAOYSA-N |
Product Overview
Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy- (CAS 7478-73-1), with molecular formula C19H20O5 and molecular weight 328.13 g/mol. IUPAC: 5-(4-benzoyloxy-3-methoxyphenyl)pentanoic acid.
Chemical Property Profile of Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-
Property Insights of Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-
The XLogP value of 4.0 indicates that Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-. Following Lipinski's Rule of Five, Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy- has 1 hydrogen bond donor(s) and 5 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 Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-?
The CAS number of Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy- is 7478-73-1.
What is the molecular formula of Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-?
The molecular formula of Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy- is C19H20O5.
What is the molecular weight of Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-?
The molecular weight of Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy- is 328.13 g/mol.
Where can I buy Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-?
You can request a quote for Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzenepentanoic acid, 4-(benzoyloxy)-3-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.