2-(2-萘硫基)乙酸
TL;DR: 2-(2-萘硫基)乙酸 (CAS 93-21-0) is a chemical compound with molecular formula C12H10O2S and molecular weight 218.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-萘硫基)乙酸
2-naphthalen-2-ylsulfanylacetic acid
Also Known As: (2-Naphthylthio)acetic acid, Brown G Acid, aceticacid, 2-Naphthylthioglycolic acid, beta-Naphthylthioglycolic acid
| Molecular Formula | C12H10O2S |
|---|---|
| Molecular Weight | 218.04 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.04015 |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 93-21-0 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)SCC(=O)O |
| InChIKey | VMZMOCBDKZHRGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-萘硫基)乙酸 (CAS 93-21-0), with molecular formula C12H10O2S and molecular weight 218.04 g/mol. IUPAC: 2-naphthalen-2-ylsulfanylacetic acid.
Chemical Property Profile of 2-(2-萘硫基)乙酸
Property Insights of 2-(2-萘硫基)乙酸
The XLogP value of 3.3 indicates that 2-(2-萘硫基)乙酸 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-(2-萘硫基)乙酸. Following Lipinski's Rule of Five, 2-(2-萘硫基)乙酸 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-(2-萘硫基)乙酸?
The CAS number of 2-(2-萘硫基)乙酸 is 93-21-0.
What is the molecular formula of 2-(2-萘硫基)乙酸?
The molecular formula of 2-(2-萘硫基)乙酸 is C12H10O2S.
What is the molecular weight of 2-(2-萘硫基)乙酸?
The molecular weight of 2-(2-萘硫基)乙酸 is 218.04 g/mol.
Where can I buy 2-(2-萘硫基)乙酸?
You can request a quote for 2-(2-萘硫基)乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-萘硫基)乙酸?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-萘硫基)乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.