2-(1-Naphthylmethylthio)propionic acid
TL;DR: 2-(1-Naphthylmethylthio)propionic acid (CAS 5261-46-1) is a chemical compound with molecular formula C14H14O2S and molecular weight 246.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(naphthalen-1-ylmethylsulfanyl)propanoic acid
Also Known As: 2-(1-Naphthylmethylthio)propionic acid, 2-(naphthylmethylthio)propanoic acid, 2-(naphthylmethylthio)propionic acid, 2-[(1-naphthylmethyl)sulfanyl]propanoic acid, 2-[(1-Naphthylmethyl)thio]propionic acid
| Molecular Formula | C14H14O2S |
|---|---|
| Molecular Weight | 246.07 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.07146 |
| Heavy Atoms | 17 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 5261-46-1 |
|---|---|
| SMILES | CC(C(=O)O)SCC1=CC=CC2=CC=CC=C21 |
| InChIKey | CAGUQMQWIJSSPX-UHFFFAOYSA-N |
Product Overview
2-(1-Naphthylmethylthio)propionic acid (CAS 5261-46-1), with molecular formula C14H14O2S and molecular weight 246.07 g/mol. IUPAC: 2-(naphthalen-1-ylmethylsulfanyl)propanoic acid.
Chemical Property Profile of 2-(1-Naphthylmethylthio)propionic acid
Property Insights of 2-(1-Naphthylmethylthio)propionic acid
The XLogP value of 3.6 indicates that 2-(1-Naphthylmethylthio)propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1-Naphthylmethylthio)propionic acid. Following Lipinski's Rule of Five, 2-(1-Naphthylmethylthio)propionic acid has 1 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 2-(1-Naphthylmethylthio)propionic acid?
The CAS number of 2-(1-Naphthylmethylthio)propionic acid is 5261-46-1.
What is the molecular formula of 2-(1-Naphthylmethylthio)propionic acid?
The molecular formula of 2-(1-Naphthylmethylthio)propionic acid is C14H14O2S.
What is the molecular weight of 2-(1-Naphthylmethylthio)propionic acid?
The molecular weight of 2-(1-Naphthylmethylthio)propionic acid is 246.07 g/mol.
Where can I buy 2-(1-Naphthylmethylthio)propionic acid?
You can request a quote for 2-(1-Naphthylmethylthio)propionic 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-Naphthylmethylthio)propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Naphthylmethylthio)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.