Methyl 2-hydroxynaphthalene-1-carbodithioate
TL;DR: Methyl 2-hydroxynaphthalene-1-carbodithioate (CAS 3152-89-4) is a chemical compound with molecular formula C12H10OS2 and molecular weight 234.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-hydroxynaphthalene-1-carbodithioate
Also Known As: Methyl 2-hydroxynaphthalene-1-carbodithioate, 1-[methylsulfanyl(sulfanyl)methylidene]naphthalen-2-one, (1Z)-1-[methylsulfanyl(sulfanyl)methylidene]naphthalen-2-one, (1Z)-1-[(Methylsulfanyl)(sulfanyl)methylidene]naphthalen-2(1H)-one
| Molecular Formula | C12H10OS2 |
|---|---|
| Molecular Weight | 234.02 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 77.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.0173 |
| Heavy Atoms | 15 |
| Complexity | 242.0 |
Chemical Identifiers
| CAS Number | 3152-89-4 |
|---|---|
| SMILES | CSC(=S)C1=C(C=CC2=CC=CC=C21)O |
| InChIKey | PIWOSLPKOORPAU-UHFFFAOYSA-N |
Product Overview
Methyl 2-hydroxynaphthalene-1-carbodithioate (CAS 3152-89-4), with molecular formula C12H10OS2 and molecular weight 234.02 g/mol. IUPAC: methyl 2-hydroxynaphthalene-1-carbodithioate.
Chemical Property Profile of Methyl 2-hydroxynaphthalene-1-carbodithioate
Property Insights of Methyl 2-hydroxynaphthalene-1-carbodithioate
The XLogP value of 3.8 indicates that Methyl 2-hydroxynaphthalene-1-carbodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-hydroxynaphthalene-1-carbodithioate. Following Lipinski's Rule of Five, Methyl 2-hydroxynaphthalene-1-carbodithioate 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 Methyl 2-hydroxynaphthalene-1-carbodithioate?
The CAS number of Methyl 2-hydroxynaphthalene-1-carbodithioate is 3152-89-4.
What is the molecular formula of Methyl 2-hydroxynaphthalene-1-carbodithioate?
The molecular formula of Methyl 2-hydroxynaphthalene-1-carbodithioate is C12H10OS2.
What is the molecular weight of Methyl 2-hydroxynaphthalene-1-carbodithioate?
The molecular weight of Methyl 2-hydroxynaphthalene-1-carbodithioate is 234.02 g/mol.
Where can I buy Methyl 2-hydroxynaphthalene-1-carbodithioate?
You can request a quote for Methyl 2-hydroxynaphthalene-1-carbodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-hydroxynaphthalene-1-carbodithioate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-hydroxynaphthalene-1-carbodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.