naphthalene-2-carbothioic S-acid
TL;DR: naphthalene-2-carbothioic S-acid (CAS 101482-14-8) is a chemical compound with molecular formula C11H8OS and molecular weight 188.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalene-2-carbothioic S-acid
Also Known As: 2-Thionaphthoic acid, beta-thionaphthoic acid, naphthalene-2-carbothioic S-acid, Naphthalene-2-thiocarboxylic acid
| Molecular Formula | C11H8OS |
|---|---|
| Molecular Weight | 188.03 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.02959 |
| Heavy Atoms | 13 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 101482-14-8 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)C(=O)S |
| InChIKey | MYWDCYJGMMRNCL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
naphthalene-2-carbothioic S-acid (CAS 101482-14-8), with molecular formula C11H8OS and molecular weight 188.03 g/mol. IUPAC: naphthalene-2-carbothioic S-acid.
Chemical Property Profile of naphthalene-2-carbothioic S-acid
Property Insights of naphthalene-2-carbothioic S-acid
The XLogP value of 3.8 indicates that naphthalene-2-carbothioic S-acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.1 Ų, naphthalene-2-carbothioic S-acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, naphthalene-2-carbothioic S-acid has 1 hydrogen bond donor(s) and 2 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 naphthalene-2-carbothioic S-acid?
The CAS number of naphthalene-2-carbothioic S-acid is 101482-14-8.
What is the molecular formula of naphthalene-2-carbothioic S-acid?
The molecular formula of naphthalene-2-carbothioic S-acid is C11H8OS.
What is the molecular weight of naphthalene-2-carbothioic S-acid?
The molecular weight of naphthalene-2-carbothioic S-acid is 188.03 g/mol.
Where can I buy naphthalene-2-carbothioic S-acid?
You can request a quote for naphthalene-2-carbothioic S-acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for naphthalene-2-carbothioic S-acid?
Yes, KEHONG BIO provides custom synthesis services for naphthalene-2-carbothioic S-acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.