1,4-Naphthalenedipropanoic acid
TL;DR: 1,4-Naphthalenedipropanoic acid (CAS 25653-19-4) is a chemical compound with molecular formula C16H16O4 and molecular weight 272.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(2-carboxyethyl)naphthalen-1-yl]propanoic acid
Also Known As: 1,4-Naphthalenedipropanoic acid, 1,4-Naphthalenedipropionic acid, 1-naphthol diphenyl phosphate, 1,4-naphthalenebispropionic acid, 3-[4-(2-carboxyethyl)naphthalen-1-yl]propanoic acid
| Molecular Formula | C16H16O4 |
|---|---|
| Molecular Weight | 272.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 272.10486 |
| Heavy Atoms | 20 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 25653-19-4 |
|---|---|
| SMILES | C1=CC=C2C(=CC=C(C2=C1)CCC(=O)O)CCC(=O)O |
| InChIKey | AMUCOYPKTLXIST-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Naphthalenedipropanoic acid (CAS 25653-19-4), with molecular formula C16H16O4 and molecular weight 272.10 g/mol. IUPAC: 3-[4-(2-carboxyethyl)naphthalen-1-yl]propanoic acid.
Chemical Property Profile of 1,4-Naphthalenedipropanoic acid
Property Insights of 1,4-Naphthalenedipropanoic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Naphthalenedipropanoic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Naphthalenedipropanoic acid. Following Lipinski's Rule of Five, 1,4-Naphthalenedipropanoic acid has 2 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 1,4-Naphthalenedipropanoic acid?
The CAS number of 1,4-Naphthalenedipropanoic acid is 25653-19-4.
What is the molecular formula of 1,4-Naphthalenedipropanoic acid?
The molecular formula of 1,4-Naphthalenedipropanoic acid is C16H16O4.
What is the molecular weight of 1,4-Naphthalenedipropanoic acid?
The molecular weight of 1,4-Naphthalenedipropanoic acid is 272.10 g/mol.
Where can I buy 1,4-Naphthalenedipropanoic acid?
You can request a quote for 1,4-Naphthalenedipropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Naphthalenedipropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Naphthalenedipropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.