Benzoic acid, 5-(heptyloxy)-2-hydroxy-
TL;DR: Benzoic acid, 5-(heptyloxy)-2-hydroxy- (CAS 127941-89-3) is a chemical compound with molecular formula C14H20O4 and molecular weight 252.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-heptoxy-2-hydroxybenzoic acid
Also Known As: p-acetylcinnamaldehyde, 5-heptoxy-2-hydroxybenzoic acid, Benzoic acid, 5-(heptyloxy)-2-hydroxy-, 5-heptoxy-2-hydroxy-benzoic Acid, 5-(HEPTYLOXY)-2-HYDROXYBENZOIC ACID
| Molecular Formula | C14H20O4 |
|---|---|
| Molecular Weight | 252.14 g/mol |
| LogP | 3.4396 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 252.13615 |
| Heavy Atoms | 18 |
| Complexity | 387.38043 |
Chemical Identifiers
| CAS Number | 127941-89-3 |
|---|---|
| SMILES | CCCCCCCOC1=CC(=C(C=C1)O)C(=O)O |
Product Overview
Benzoic acid, 5-(heptyloxy)-2-hydroxy- (CAS 127941-89-3), with molecular formula C14H20O4 and molecular weight 252.14 g/mol. IUPAC: 5-heptoxy-2-hydroxybenzoic acid.
Chemical Property Profile of Benzoic acid, 5-(heptyloxy)-2-hydroxy-
Property Insights of Benzoic acid, 5-(heptyloxy)-2-hydroxy-
The XLogP value of 3.4396 indicates that Benzoic acid, 5-(heptyloxy)-2-hydroxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 5-(heptyloxy)-2-hydroxy-. Following Lipinski's Rule of Five, Benzoic acid, 5-(heptyloxy)-2-hydroxy- has 2 hydrogen bond donor(s) and 3 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 Benzoic acid, 5-(heptyloxy)-2-hydroxy-?
The CAS number of Benzoic acid, 5-(heptyloxy)-2-hydroxy- is 127941-89-3.
What is the molecular formula of Benzoic acid, 5-(heptyloxy)-2-hydroxy-?
The molecular formula of Benzoic acid, 5-(heptyloxy)-2-hydroxy- is C14H20O4.
What is the molecular weight of Benzoic acid, 5-(heptyloxy)-2-hydroxy-?
The molecular weight of Benzoic acid, 5-(heptyloxy)-2-hydroxy- is 252.14 g/mol.
Where can I buy Benzoic acid, 5-(heptyloxy)-2-hydroxy-?
You can request a quote for Benzoic acid, 5-(heptyloxy)-2-hydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 5-(heptyloxy)-2-hydroxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 5-(heptyloxy)-2-hydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.