2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid
TL;DR: 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid (CAS 81886-52-4) is a chemical compound with molecular formula C18H16O4 and molecular weight 296.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,2,3,4-tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid
Also Known As: 2-(1,2,3,4-tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid, 2-[(1,2,3,4-tetrahydronaphthalen-1-yloxy)carbonyl]benzoic acid, 2-(((1,2,3,4-Tetrahydronaphthalen-1-yl)oxy)carbonyl)benzoic acid, 2-{[(1,2,3,4-Tetrahydronaphthalen-1-yl)oxy]carbonyl}benzoic acid, 1,2-Benzenedicarboxylicacid, 1-(1,2,3,4-tetrahydro-1-naphthalenyl) ester
| Molecular Formula | C18H16O4 |
|---|---|
| Molecular Weight | 296.10 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 296.10486 |
| Heavy Atoms | 22 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 81886-52-4 |
|---|---|
| SMILES | C1CC(C2=CC=CC=C2C1)OC(=O)C3=CC=CC=C3C(=O)O |
| InChIKey | FZBWIPGCMHFRTD-UHFFFAOYSA-N |
Product Overview
2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid (CAS 81886-52-4), with molecular formula C18H16O4 and molecular weight 296.10 g/mol. IUPAC: 2-(1,2,3,4-tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid.
Chemical Property Profile of 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid
Property Insights of 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid
The XLogP value of 3.6 indicates that 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid. Following Lipinski's Rule of Five, 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid has 1 hydrogen bond donor(s) and 4 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 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid?
The CAS number of 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid is 81886-52-4.
What is the molecular formula of 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid?
The molecular formula of 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid is C18H16O4.
What is the molecular weight of 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid?
The molecular weight of 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid is 296.10 g/mol.
Where can I buy 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid?
You can request a quote for 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,2,3,4-Tetrahydronaphthalen-1-yloxycarbonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.